{ "meta": { "disclaimer": "Do not rely on openFDA to make decisions regarding medical care. While we make every effort to ensure that data is accurate, you should assume all results are unvalidated. We may limit or otherwise restrict your access to the API in line with our Terms of Service.", "terms": "https://open.fda.gov/terms/", "license": "https://open.fda.gov/license/", "last_updated": "2026-09-09", "results": { "skip": 0, "limit": 1, "total": 1 } }, "results": [ { "codes": [ { "uuid": "56fb70f7-742b-4cdf-93ca-5d0ccab2f73a", "code": "1307093", "comments": "RxNorm", "type": "PRIMARY", "url": "https://rxnav.nlm.nih.gov/REST/rxcui/1307093/allProperties.xml?prop=all", "code_system": "RXCUI", "references": [ "e884d7b0-3eaa-4cc2-bca4-ff67f95decd2" ] }, { "uuid": "f4e44e9f-640c-3892-f819-75b0be97467d", "code": "135390901", "type": "PRIMARY", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/135390901", "code_system": "PUBCHEM", "references": [ "7799751c-33ca-3e1b-a51b-cb337f999a47" ] }, { "uuid": "e532d252-eb70-4754-9e0d-05b3de9dfa9b", "code": "W6000VEI5Y", "type": "PRIMARY", "code_system": "FDA UNII" }, { "uuid": "ca8c7e01-5b3a-5e69-3760-daa2d118909e", "code": "W6000VEI5Y", "type": "PRIMARY", "url": "https://dailymed.nlm.nih.gov/dailymed/search.cfm?adv=1&query=W6000VEI5Y", "code_system": "DAILYMED", "references": [ "531214a4-82bf-73e9-1ffe-354cd10a8e7c" ] }, { "uuid": "11ccf986-d8a0-46a7-c2d3-4446863d2a73", "code": "300000041331", "type": "PRIMARY", "code_system": "SMS_ID", "references": [ "2818fbd3-de52-b216-32c1-17ccb4bf8527" ] } ], "substance_class": "chemical", "names": [ { "uuid": "5805aec2-0d25-444e-b05c-0c93f9798ec3", "name": "COLALIPID ST", "stdName": "COLALIPID ST", "type": "cn", "languages": [ "en" ], "preferred": false, "references": [ "f5052880-35a6-4ac9-92f7-e970ac8aaf88", "2ff96b0e-ed83-4826-a9c4-f6d3d1ca5c67" ], "display_name": false }, { "uuid": "4909793c-bef2-474d-8d60-5ff014d2c994", "name": "STEARAMIDOPROPYL PG-DIMONIUM CHLORIDE PHOSPHATE", "stdName": "STEARAMIDOPROPYL PG-DIMONIUM CHLORIDE PHOSPHATE", "type": "of", "languages": [ "en" ], "preferred": true, "references": [ "6104d2a3-29ef-4926-9c2d-ff6847ce233d", "78165e25-0fbf-4722-a915-1d1711687752", "f5052880-35a6-4ac9-92f7-e970ac8aaf88", "2ff96b0e-ed83-4826-a9c4-f6d3d1ca5c67" ], "display_name": false, "domains": [ "cosmetic" ], "name_orgs": [ { "uuid": "9a15ba4a-d8d3-417e-b933-e9b2f4a7311b", "name_org": "INCI" } ] }, { "uuid": "4a5e55ac-2c3f-4039-9d85-9d9d2eb476f9", "name": "STEARAMIDOPROPYL PROPYLENE GLYCOL-DIMONIUM CHLORIDE PHOSPHATE", "stdName": "STEARAMIDOPROPYL PROPYLENE GLYCOL-DIMONIUM CHLORIDE PHOSPHATE", "type": "cn", "languages": [ "en" ], "preferred": false, "references": [ "2ff96b0e-ed83-4826-a9c4-f6d3d1ca5c67", "97740380-a99c-4a59-90c2-97747e3c4ebb" ], "display_name": true } ], "references": [ { "uuid": "f5052880-35a6-4ac9-92f7-e970ac8aaf88", "citation": "PCPC", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN", "PUBLIC_DOMAIN_RELEASE", "AUTO_SELECTED" ] }, { "uuid": "78165e25-0fbf-4722-a915-1d1711687752", "citation": "DL", "doc_type": "PERSONAL CARE PRODUCTS COUNCIL", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "2ff96b0e-ed83-4826-a9c4-f6d3d1ca5c67", "citation": "PERSONAL CARE PRODUCTS COUNCIL", "doc_type": "PERSONAL CARE PRODUCTS COUNCIL", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "97740380-a99c-4a59-90c2-97747e3c4ebb", "citation": "FDA_SRS", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "e884d7b0-3eaa-4cc2-bca4-ff67f95decd2", "citation": "SRS CODE IMPORT", "doc_type": "SRS", "public_domain": true, "document_date": 1493390520000, "tags": [ "NOMEN" ] }, { "uuid": "a0cfe677-0581-42fb-a985-d9b89e4c3534", "citation": "SRS import [W6000VEI5Y]", "url": "http://fdasis.nlm.nih.gov/srs/srsdirect.jsp?regno=W6000VEI5Y", "doc_type": "SRS", "public_domain": true, "document_date": 1493390520000, "tags": [ "NOMEN" ] }, { "uuid": "11747a8d-46b8-4c99-b2af-c58128b38e5d", "citation": "pcpc-db", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "6104d2a3-29ef-4926-9c2d-ff6847ce233d", "citation": "STEARAMIDOPROPYL PG-DIMONIUM CHLORIDE PHOSPHATE [INCI]", "doc_type": "SRS_LOCATOR", "public_domain": true }, { "uuid": "7799751c-33ca-3e1b-a51b-cb337f999a47", "citation": "PUBCHEM", "doc_type": "PUBCHEM", "public_domain": true }, { "uuid": "531214a4-82bf-73e9-1ffe-354cd10a8e7c", "citation": "DailyMed", "doc_type": "DAILYMED", "public_domain": true }, { "uuid": "2818fbd3-de52-b216-32c1-17ccb4bf8527", "citation": "EU-SRS", "doc_type": "EMA LIST", "public_domain": true } ], "definition_type": "PRIMARY", "moieties": [ { "uuid": "6765da0d-57bb-45da-99f6-287af585b638", "id": "6765da0d-57bb-45da-99f6-287af585b638", "molfile": "\n Marvin 01132105232D \n\n 1 0 0 0 0 0 999 V2000\n -1.4000 -8.4579 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0\nM END", "smiles": "Cl", "formula": "ClH", "atropisomerism": "No", "charge": 0, "count": 3, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 3, "units": "MOL RATIO", "uuid": "3065e8a3-065c-47e5-8b4e-e388cfe0638f" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "36.4609", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "609280d2-15d6-44b6-8fd8-39bfd37b5b35", "id": "609280d2-15d6-44b6-8fd8-39bfd37b5b35", "molfile": "\n Marvin 01132105002D \n\n 95 94 0 0 0 0 999 V2000\n 18.7283 -3.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 18.0084 -3.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 17.2979 -3.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 16.5780 -3.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 15.8535 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 15.1476 -3.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 14.4278 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.7032 -3.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.9974 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.2775 -3.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.5671 -3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.8518 -3.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.1320 -3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 9.4168 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.6969 -3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.9864 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.2712 -3.2646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.5513 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.5513 -4.5080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.8408 -3.2646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 5.1209 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.4104 -3.2646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.6905 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.9707 -3.2646 0.0000 N 0 3 0 0 0 0 0 0 0 3 0 0\n 2.7463 -2.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.5830 -2.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.2601 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.5403 -3.2553 0.0000 C 0 0 0 0 0 0 0 0 0 3 0 0\n 1.5403 -2.4278 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0\n 0.8344 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 0.1099 -3.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -0.6848 -3.0308 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0\n -0.6848 -3.8489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -1.3860 -2.6008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -2.1338 -3.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -2.1338 -3.8256 0.0000 C 0 0 0 0 0 0 0 0 0 3 0 0\n -1.4233 -4.2556 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0\n -2.8724 -4.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -2.8724 -5.0549 0.0000 N 0 3 0 0 0 0 0 0 0 3 0 0\n -2.8724 -5.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -3.7186 -4.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -1.7553 -5.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -1.0447 -5.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -0.3623 -5.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 0.3857 -5.3448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 1.0634 -5.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.0074 -6.6069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 1.7974 -5.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.4752 -5.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.2137 -5.5598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.9009 -6.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.6161 -5.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.2939 -6.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.0371 -5.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7150 -6.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.4442 -5.8496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.1266 -6.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.8651 -5.9478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 9.5337 -6.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.2629 -6.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.9453 -6.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.6838 -6.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.3663 -6.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.0955 -6.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -0.1799 -2.1848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 0.6755 -2.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.0355 -1.6520 0.0000 C 0 0 0 0 0 0 0 0 0 3 0 0\n 0.8017 -0.9695 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0\n 1.9330 -1.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.4659 -1.1799 0.0000 N 0 3 0 0 0 0 0 0 0 3 0 0\n 2.1667 -0.3758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.0408 -0.3851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.2651 -1.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.9617 -1.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.6955 -1.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.3921 -1.1564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1213 -1.5351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1213 -2.3578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.8224 -1.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.5517 -1.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2528 -1.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.9820 -1.4323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 9.6925 -0.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.4217 -1.3855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.1183 -0.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.8521 -1.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.5487 -0.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.2779 -1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.9791 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 14.7083 -1.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 15.4095 -0.7918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 16.1387 -1.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 16.8351 -0.7450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 17.5691 -1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 18.2655 -0.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1 2 1 0 0 0 0\n 2 3 1 0 0 0 0\n 3 4 1 0 0 0 0\n 4 5 1 0 0 0 0\n 5 6 1 0 0 0 0\n 6 7 1 0 0 0 0\n 7 8 1 0 0 0 0\n 8 9 1 0 0 0 0\n 9 10 1 0 0 0 0\n 10 11 1 0 0 0 0\n 11 12 1 0 0 0 0\n 12 13 1 0 0 0 0\n 13 14 1 0 0 0 0\n 14 15 1 0 0 0 0\n 15 16 1 0 0 0 0\n 16 17 1 0 0 0 0\n 17 18 1 0 0 0 0\n 19 18 2 0 0 0 0\n 18 20 1 0 0 0 0\n 20 21 1 0 0 0 0\n 21 22 1 0 0 0 0\n 22 23 1 0 0 0 0\n 23 24 1 0 0 0 0\n 25 24 1 0 0 0 0\n 26 24 1 0 0 0 0\n 24 27 1 0 0 0 0\n 27 28 1 0 0 0 0\n 29 28 1 0 0 0 0\n 28 30 1 0 0 0 0\n 30 31 1 0 0 0 0\n 31 32 1 0 0 0 0\n 33 32 2 0 0 0 0\n 34 32 1 0 0 0 0\n 65 32 1 0 0 0 0\n 35 34 1 0 0 0 0\n 36 35 1 0 0 0 0\n 37 36 1 0 0 0 0\n 38 36 1 0 0 0 0\n 39 38 1 0 0 0 0\n 40 39 1 0 0 0 0\n 41 39 1 0 0 0 0\n 42 39 1 0 0 0 0\n 43 42 1 0 0 0 0\n 44 43 1 0 0 0 0\n 45 44 1 0 0 0 0\n 46 45 1 0 0 0 0\n 47 46 2 0 0 0 0\n 48 46 1 0 0 0 0\n 49 48 1 0 0 0 0\n 50 49 1 0 0 0 0\n 51 50 1 0 0 0 0\n 52 51 1 0 0 0 0\n 53 52 1 0 0 0 0\n 54 53 1 0 0 0 0\n 55 54 1 0 0 0 0\n 56 55 1 0 0 0 0\n 57 56 1 0 0 0 0\n 58 57 1 0 0 0 0\n 59 58 1 0 0 0 0\n 60 59 1 0 0 0 0\n 61 60 1 0 0 0 0\n 62 61 1 0 0 0 0\n 63 62 1 0 0 0 0\n 64 63 1 0 0 0 0\n 66 65 1 0 0 0 0\n 67 66 1 0 0 0 0\n 68 67 1 0 0 0 0\n 69 67 1 0 0 0 0\n 70 69 1 0 0 0 0\n 71 70 1 0 0 0 0\n 72 70 1 0 0 0 0\n 73 70 1 0 0 0 0\n 74 73 1 0 0 0 0\n 75 74 1 0 0 0 0\n 76 75 1 0 0 0 0\n 77 76 1 0 0 0 0\n 78 77 2 0 0 0 0\n 79 77 1 0 0 0 0\n 80 79 1 0 0 0 0\n 81 80 1 0 0 0 0\n 82 81 1 0 0 0 0\n 83 82 1 0 0 0 0\n 84 83 1 0 0 0 0\n 85 84 1 0 0 0 0\n 86 85 1 0 0 0 0\n 87 86 1 0 0 0 0\n 88 87 1 0 0 0 0\n 89 88 1 0 0 0 0\n 90 89 1 0 0 0 0\n 91 90 1 0 0 0 0\n 92 91 1 0 0 0 0\n 93 92 1 0 0 0 0\n 94 93 1 0 0 0 0\n 95 94 1 0 0 0 0\nM CHG 6 24 1 29 -1 37 -1 39 1 68 -1 70 1\nM END", "smiles": "CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(COP(=O)(OCC(C[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCCCC)[O-])OCC(C[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCCCC)[O-])[O-]", "formula": "C78H159N6O10P", "atropisomerism": "No", "charge": 0, "count": 1, "stereochemistry": "MIXED", "count_amount": { "type": "MOL RATIO", "average": 1, "units": "MOL RATIO", "uuid": "048863cb-30e3-4e39-8119-cc2d4c4294ce" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "1372.108", "optical_activity": "UNSPECIFIED", "stereo_centers": 3 } ], "definition_level": "COMPLETE", "uuid": "181e3004-b8b6-4b04-87b9-df55ddd7c6ed", "version": "6", "structure": { "id": "2027886c-3c73-4d7e-89ce-182597f66c30", "molfile": "\n Marvin 01132101492D \n\n 98 94 0 0 0 0 999 V2000\n -0.6848 -3.0308 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0\n 0.1099 -3.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 0.8344 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.5403 -3.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.2601 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.9707 -3.2646 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0\n 3.6905 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.4104 -3.2646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.1209 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.8408 -3.2646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 6.5513 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.5513 -4.5080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 7.2712 -3.2646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.9864 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.6969 -3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 9.4168 -3.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.1320 -3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.8518 -3.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.5671 -3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.2775 -3.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.9974 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.7032 -3.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 14.4278 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 15.1476 -3.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 15.8535 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 16.5780 -3.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 17.2979 -3.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 18.0084 -3.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 18.7283 -3.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.7463 -2.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.5830 -2.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.5403 -2.4278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -1.3860 -2.6008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -2.1338 -3.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -2.1338 -3.8256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -2.8724 -4.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -2.8724 -5.0549 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0\n -1.7553 -5.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -1.0447 -5.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -0.3623 -5.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 0.3857 -5.3448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 1.0634 -5.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.0074 -6.6069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 1.7974 -5.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.4752 -5.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.2137 -5.5598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.9009 -6.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.6161 -5.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.2939 -6.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.0371 -5.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7150 -6.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.4442 -5.8496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.1266 -6.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.8651 -5.9478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 9.5337 -6.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.2629 -6.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.9453 -6.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.6838 -6.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.3663 -6.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.0955 -6.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -2.8724 -5.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -3.7186 -4.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -1.4233 -4.2556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -0.1799 -2.1848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 0.6755 -2.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.0355 -1.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.9330 -1.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.4659 -1.1799 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0\n 3.2651 -1.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.9617 -1.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.6955 -1.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.3921 -1.1564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1213 -1.5351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1213 -2.3578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.8224 -1.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.5517 -1.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2528 -1.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.9820 -1.4323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 9.6925 -0.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 10.4217 -1.3855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.1183 -0.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 11.8521 -1.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 12.5487 -0.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.2779 -1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 13.9791 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 14.7083 -1.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 15.4095 -0.7918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 16.1387 -1.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 16.8351 -0.7450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 17.5691 -1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 18.2655 -0.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.1667 -0.3758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.0408 -0.3851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 0.8017 -0.9695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -0.6848 -3.8489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -1.4000 -8.4579 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0\n -1.4000 -8.4579 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0\n -1.4000 -8.4579 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0\n 4 3 1 0 0 0 0\n 5 4 1 0 0 0 0\n 6 5 1 0 0 0 0\n 7 6 1 0 0 0 0\n 8 7 1 0 0 0 0\n 9 8 1 0 0 0 0\n 10 9 1 0 0 0 0\n 11 10 1 0 0 0 0\n 12 11 2 0 0 0 0\n 13 11 1 0 0 0 0\n 14 13 1 0 0 0 0\n 15 14 1 0 0 0 0\n 16 15 1 0 0 0 0\n 17 16 1 0 0 0 0\n 18 17 1 0 0 0 0\n 19 18 1 0 0 0 0\n 20 19 1 0 0 0 0\n 21 20 1 0 0 0 0\n 22 21 1 0 0 0 0\n 23 22 1 0 0 0 0\n 24 23 1 0 0 0 0\n 25 24 1 0 0 0 0\n 26 25 1 0 0 0 0\n 27 26 1 0 0 0 0\n 28 27 1 0 0 0 0\n 29 28 1 0 0 0 0\n 30 6 1 0 0 0 0\n 31 6 1 0 0 0 0\n 32 4 1 0 0 0 0\n 33 1 1 0 0 0 0\n 34 33 1 0 0 0 0\n 35 34 1 0 0 0 0\n 36 35 1 0 0 0 0\n 37 36 1 0 0 0 0\n 38 37 1 0 0 0 0\n 39 38 1 0 0 0 0\n 40 39 1 0 0 0 0\n 41 40 1 0 0 0 0\n 42 41 1 0 0 0 0\n 43 42 2 0 0 0 0\n 44 42 1 0 0 0 0\n 45 44 1 0 0 0 0\n 46 45 1 0 0 0 0\n 47 46 1 0 0 0 0\n 48 47 1 0 0 0 0\n 49 48 1 0 0 0 0\n 50 49 1 0 0 0 0\n 51 50 1 0 0 0 0\n 52 51 1 0 0 0 0\n 53 52 1 0 0 0 0\n 54 53 1 0 0 0 0\n 55 54 1 0 0 0 0\n 56 55 1 0 0 0 0\n 57 56 1 0 0 0 0\n 58 57 1 0 0 0 0\n 59 58 1 0 0 0 0\n 60 59 1 0 0 0 0\n 61 37 1 0 0 0 0\n 62 37 1 0 0 0 0\n 63 35 1 0 0 0 0\n 64 1 1 0 0 0 0\n 65 64 1 0 0 0 0\n 66 65 1 0 0 0 0\n 67 66 1 0 0 0 0\n 68 67 1 0 0 0 0\n 69 68 1 0 0 0 0\n 70 69 1 0 0 0 0\n 71 70 1 0 0 0 0\n 72 71 1 0 0 0 0\n 73 72 1 0 0 0 0\n 74 73 2 0 0 0 0\n 75 73 1 0 0 0 0\n 76 75 1 0 0 0 0\n 77 76 1 0 0 0 0\n 78 77 1 0 0 0 0\n 79 78 1 0 0 0 0\n 80 79 1 0 0 0 0\n 81 80 1 0 0 0 0\n 82 81 1 0 0 0 0\n 83 82 1 0 0 0 0\n 84 83 1 0 0 0 0\n 85 84 1 0 0 0 0\n 86 85 1 0 0 0 0\n 87 86 1 0 0 0 0\n 88 87 1 0 0 0 0\n 89 88 1 0 0 0 0\n 90 89 1 0 0 0 0\n 91 90 1 0 0 0 0\n 92 68 1 0 0 0 0\n 93 68 1 0 0 0 0\n 94 66 1 0 0 0 0\n 95 1 2 0 0 0 0\n 2 1 1 0 0 0 0\n 3 2 1 0 0 0 0\nM CHG 6 6 1 37 1 68 1 96 -1 97 -1 98 -1\nM STY 1 1 MUL\nM SCN 1 1 HT \nM SAL 1 3 96 97 98\nM SPA 1 1 96\nM SDI 1 4 -1.8200 -8.8779 -1.8200 -8.0379\nM SDI 1 4 -0.9800 -8.0379 -0.9800 -8.8779\nM SMT 1 3\nM END", "smiles": "CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(COP(=O)(OCC(C[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCCCC)O)OCC(C[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCCCC)O)O.[Cl-].[Cl-].[Cl-]", "formula": "C78H162N6O10P.3Cl", "atropisomerism": "No", "charge": 0, "count": 1, "stereochemistry": "MIXED", "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "1481.4906", "optical_activity": "UNSPECIFIED", "references": [ "a0cfe677-0581-42fb-a985-d9b89e4c3534", "11747a8d-46b8-4c99-b2af-c58128b38e5d" ], "stereo_centers": 3 }, "unii": "W6000VEI5Y" } ] }