{ "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": "2025-09-19", "results": { "skip": 0, "limit": 1, "total": 1 } }, "results": [ { "codes": [ { "uuid": "2a282436-58bb-403a-914b-e7241beb7af5", "code": "12173-60-3", "type": "PRIMARY", "url": "https://commonchemistry.cas.org/detail?cas_rn=12173-60-3", "code_system": "CAS", "references": [ "3cb763d2-4879-4c64-96f4-1c95074df43e", "b1ff8518-cda8-4736-b635-55d03e45df29" ] }, { "uuid": "f4285c8e-6b39-4f28-b305-4418516c4445", "code": "1661716", "comments": "RxNorm", "type": "PRIMARY", "url": "https://rxnav.nlm.nih.gov/REST/rxcui/1661716/allProperties.xml?prop=all", "code_system": "RXCUI", "references": [ "3cb763d2-4879-4c64-96f4-1c95074df43e" ] }, { "uuid": "1a271016-c470-42e9-ad0b-7b7d03d28139", "code": "86278147", "type": "PRIMARY", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/86278147", "code_system": "PUBCHEM", "references": [ "3cb763d2-4879-4c64-96f4-1c95074df43e" ] }, { "uuid": "45fbba37-f777-cfec-78de-82387f08e76c", "code": "DTXSID3052779", "type": "PRIMARY", "url": "https://comptox.epa.gov/dashboard/chemical/details/DTXSID3052779", "code_system": "EPA CompTox", "references": [ "d47e2292-da9d-6080-18ac-5e0e50d0bcda" ] }, { "uuid": "1ec0f713-0c09-4f87-8773-984e899412a5", "code": "D7BC5B0F46", "type": "PRIMARY", "code_system": "FDA UNII" }, { "uuid": "d5d662a1-c81b-2e2d-d83d-5e632d28a6ef", "code": "D7BC5B0F46", "type": "PRIMARY", "url": "https://dailymed.nlm.nih.gov/dailymed/search.cfm?adv=1&query=(D7BC5B0F46)", "code_system": "DAILYMED", "references": [ "58de67ac-2f85-6ff4-9e2d-e5f38149a3a4" ] } ], "substance_class": "chemical", "names": [ { "uuid": "107e3900-6ea8-475a-9be7-a0826fe784bb", "name": "ILLITE", "stdName": "ILLITE", "type": "of", "languages": [ "en" ], "preferred": true, "references": [ "ad70d9e6-5e07-4eb4-9959-85f5a471f52e" ], "display_name": false, "domains": [ "cosmetic" ], "name_orgs": [ { "uuid": "5a7d91a3-d144-4f24-9888-aff38be3b0bd", "name_org": "INCI" } ] }, { "uuid": "1d3f6dd3-d507-4052-a594-ee1550f0f59a", "name": "ILLITE ((AL1.75(FE0-1MG0-1)0.25)K0.75(SI3.5AL0.5)((OH)0.5-1F0-0.5)2O10)", "stdName": "ILLITE ((AL1.75(FE0-1MG0-1)0.25)K0.75(SI3.5AL0.5)((OH)0.5-1F0-0.5)2O10)", "type": "sys", "languages": [ "en" ], "preferred": false, "references": [ "cab0ce97-bd25-48da-b2fa-b85e8574d9f7" ], "display_name": false }, { "uuid": "0a3c6abc-24a7-4f55-965c-c4f241075ed7", "name": "LEDIKITE", "stdName": "LEDIKITE", "type": "cn", "languages": [ "en" ], "preferred": false, "references": [ "cab0ce97-bd25-48da-b2fa-b85e8574d9f7" ], "display_name": true } ], "references": [ { "uuid": "cab0ce97-bd25-48da-b2fa-b85e8574d9f7", "citation": "STN", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "3cb763d2-4879-4c64-96f4-1c95074df43e", "citation": "SRS CODE IMPORT", "doc_type": "SRS", "public_domain": true, "document_date": 1493392799000, "tags": [ "NOMEN" ] }, { "uuid": "8302fc98-adc7-4745-98a5-ea88fcfb6e97", "citation": "SRS import [D7BC5B0F46]", "url": "http://fdasis.nlm.nih.gov/srs/srsdirect.jsp?regno=D7BC5B0F46", "doc_type": "SRS", "public_domain": true, "document_date": 1493392799000, "tags": [ "NOMEN" ] }, { "uuid": "ad70d9e6-5e07-4eb4-9959-85f5a471f52e", "citation": "CFSAN", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN", "PUBLIC_DOMAIN_RELEASE", "AUTO_SELECTED" ] }, { "uuid": "d47e2292-da9d-6080-18ac-5e0e50d0bcda", "citation": "WEBSITE", "url": "https://comptox.epa.gov/dashboard/dsstoxdb/results?utf8=%E2%9C%93&search=12173-60-3", "doc_type": "WEBSITE", "public_domain": true, "tags": [ "NOMEN", "PUBLIC_DOMAIN_RELEASE" ] }, { "uuid": "e37202b3-b3f1-1b14-5cd2-894a1f7bbedb", "citation": "PCPC", "doc_type": "PERSONAL CARE PRODUCTS COUNCIL", "public_domain": true }, { "uuid": "b1ff8518-cda8-4736-b635-55d03e45df29", "citation": "STN", "doc_type": "STN (SCIFINDER)", "public_domain": true }, { "uuid": "58de67ac-2f85-6ff4-9e2d-e5f38149a3a4", "citation": "DAILYMED", "doc_type": "DAILYMED", "public_domain": true } ], "definition_type": "PRIMARY", "moieties": [ { "uuid": "47707bb9-e383-46f5-80f5-6cce012cb471", "id": "47707bb9-e383-46f5-80f5-6cce012cb471", "molfile": "\n CDK 07172416392D\n\n 7 8 0 0 0 0 0 0 0 0999 V2000\n 16.1150 -14.9208 0.0000 Si 0 0 0 0 0 0 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 0 0 0 0 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0\n 1 3 1 0 0 0 0\n 3 2 1 0 0 0 0\n 2 4 1 0 0 0 0\n 4 1 1 0 0 0 0\n 1 5 1 0 0 0 0\n 2 5 1 0 0 0 0\n 1 6 1 0 0 0 0\n 2 7 1 0 0 0 0\nM CHG 1 6 -1\nM CHG 1 7 -1\nM END", "smiles": "[O-][Si]12O[Si]([O-])(O1)O2", "formula": "O5Si2", "atropisomerism": "No", "charge": -2, "count": 7, "stereochemistry": "MIXED", "count_amount": { "type": "MOL RATIO", "average": 7, "units": "MOL RATIO", "uuid": "cfe45ff4-91e9-48d6-aab4-551cd35a013f" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "136.1678", "optical_activity": "UNSPECIFIED", "stereo_centers": 2 }, { "uuid": "8fc9fd6f-47f0-4912-9e20-ac83fc545b0e", "id": "8fc9fd6f-47f0-4912-9e20-ac83fc545b0e", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 12.5212 -10.3270 0.0000 O 0 6 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 -2\nM END", "smiles": "[O-2]", "formula": "O", "atropisomerism": "No", "charge": -2, "count": 5, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 5, "units": "MOL RATIO", "uuid": "65d8204b-87f0-48f1-af3e-41eab4c659a0" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "15.9994", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "9fd72c0d-e9b8-4ad9-9e8d-a3c9a28fccca", "id": "9fd72c0d-e9b8-4ad9-9e8d-a3c9a28fccca", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 16.0837 -10.2333 0.0000 F 0 5 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 -1\nM STY 1 1 GEN\nM SAL 1 1 1\nM SDI 1 4 15.4214 -10.9507 15.4214 -9.3660\nM SDI 1 4 16.9657 -9.3660 16.9657 -10.9507\nM END", "smiles": "[F-]", "formula": "F", "atropisomerism": "No", "charge": -1, "count": 1, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 1, "units": "MOL RATIO", "uuid": "61314618-a19e-4c12-861f-782c7980572b" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "18.9984", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "e9f58975-f661-4274-817c-20f63876c6ee", "id": "e9f58975-f661-4274-817c-20f63876c6ee", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 5.0525 -10.4833 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 1\nM END", "smiles": "[K+]", "formula": "K", "atropisomerism": "No", "charge": 1, "count": 3, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 3, "units": "MOL RATIO", "uuid": "c33628f9-bcb6-4beb-8ab2-94f53e7ef607" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "39.0983", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "2cb56464-4f8b-4a41-8696-1e4088a50445", "id": "2cb56464-4f8b-4a41-8696-1e4088a50445", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 3\nM END", "smiles": "[Al+3]", "formula": "Al", "atropisomerism": "No", "charge": 3, "count": 9, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 9, "units": "MOL RATIO", "uuid": "82459c2e-3c69-4333-aa81-f3af31253e23" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "26.9815", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "8b958eaa-0bc5-48ef-a160-f2b5a11d15c5", "id": "8b958eaa-0bc5-48ef-a160-f2b5a11d15c5", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 19.1462 -10.1083 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 -1\nM STY 1 1 GEN\nM SAL 1 1 1\nM SDI 1 4 18.4500 -10.8257 18.4500 -9.2098\nM SDI 1 4 20.4006 -9.2098 20.4006 -10.8257\nM END", "smiles": "[OH-]", "formula": "HO", "atropisomerism": "No", "charge": -1, "count": 1, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 1, "units": "MOL RATIO", "uuid": "4198241e-5460-44bd-868d-bbd952cb8a07" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "17.0073", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "e2a46ef5-fef1-4563-810c-0c94b4bb83a0", "id": "e2a46ef5-fef1-4563-810c-0c94b4bb83a0", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 5.1775 -14.9520 0.0000 Mg 0 2 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 2\nM STY 1 1 GEN\nM SAL 1 1 1\nM SDI 1 4 4.4701 -15.6694 4.4701 -14.0848\nM SDI 1 4 6.5174 -14.0848 6.5174 -15.6694\nM END", "smiles": "[Mg+2]", "formula": "Mg", "atropisomerism": "No", "charge": 2, "count": 1, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 1, "units": "MOL RATIO", "uuid": "9c86d540-fd5f-42da-9db9-3cb86f96e809" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "24.3051", "optical_activity": "NONE", "stereo_centers": 0 }, { "uuid": "844c28ce-d21e-4974-ab69-85b1083aa9aa", "id": "844c28ce-d21e-4974-ab69-85b1083aa9aa", "molfile": "\n CDK 07172416392D\n\n 1 0 0 0 0 0 0 0 0 0999 V2000\n 8.6775 -15.0145 0.0000 Fe 0 2 0 0 0 0 0 0 0 0 0 0\nM CHG 1 1 2\nM STY 1 1 GEN\nM SAL 1 1 1\nM SDI 1 4 8.0151 -15.7319 8.0151 -14.1473\nM SDI 1 4 9.9687 -14.1473 9.9687 -15.7319\nM END", "smiles": "[Fe+2]", "formula": "Fe", "atropisomerism": "No", "charge": 2, "count": 1, "stereochemistry": "ACHIRAL", "count_amount": { "type": "MOL RATIO", "average": 1, "units": "MOL RATIO", "uuid": "84b23e51-0a2d-4434-a524-60a8a87f315b" }, "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "55.8451", "optical_activity": "NONE", "stereo_centers": 0 } ], "definition_level": "INCOMPLETE", "uuid": "3cf54db0-119e-444e-bd19-0cc71767184c", "version": "6", "structure": { "id": "3e97798d-9854-4aba-ba85-c5a7e8b930a7", "molfile": "\n Symyx 04271720402D 1 1.00000 0.00000 0\n\n 70 56 0 0 0 0 999 V2000\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 12.5212 -10.3270 0.0000 O 0 6 0 0 0 0 0 0 0\n 16.0837 -10.2333 0.0000 F 0 5 0 0 0 0 0 0 0\n 5.0525 -10.4833 0.0000 K 0 3 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 19.1462 -10.1083 0.0000 O 0 5 0 0 0 0 0 0 0\n 5.1775 -14.9520 0.0000 Mg 0 2 0 0 0 0 0 0 0\n 8.6775 -15.0145 0.0000 Fe 0 2 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 8.3337 -10.3583 0.0000 Al 0 1 0 0 0 0 0 0 0\n 5.0525 -10.4833 0.0000 K 0 3 0 0 0 0 0 0 0\n 5.0525 -10.4833 0.0000 K 0 3 0 0 0 0 0 0 0\n 12.5212 -10.3270 0.0000 O 0 6 0 0 0 0 0 0 0\n 12.5212 -10.3270 0.0000 O 0 6 0 0 0 0 0 0 0\n 12.5212 -10.3270 0.0000 O 0 6 0 0 0 0 0 0 0\n 12.5212 -10.3270 0.0000 O 0 6 0 0 0 0 0 0 0\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 16.1150 -14.9208 0.0000 Si 0 0 3 0 0 0 0 0 0\n 18.4587 -14.7333 0.0000 Si 0 0 3 0 0 0 0 0 0\n 17.1743 -13.8041 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.4900 -16.1708 0.0000 O 0 0 0 0 0 0 0 0 0\n 17.3586 -14.9208 0.0000 O 0 0 0 0 0 0 0 0 0\n 14.9338 -14.9208 0.0000 O 0 5 0 0 0 0 0 0 0\n 19.6398 -14.7333 0.0000 O 0 5 0 0 0 0 0 0 0\n 1 3 1 0 0 0\n 3 2 1 0 0 0\n 2 4 1 0 0 0\n 4 1 1 0 0 0\n 1 5 1 0 0 0\n 2 5 1 0 0 0\n 1 6 1 0 0 0\n 2 7 1 0 0 0\n 29 31 1 0 0 0\n 31 30 1 0 0 0\n 30 32 1 0 0 0\n 32 29 1 0 0 0\n 29 33 1 0 0 0\n 30 33 1 0 0 0\n 29 34 1 0 0 0\n 30 35 1 0 0 0\n 36 38 1 0 0 0\n 38 37 1 0 0 0\n 37 39 1 0 0 0\n 39 36 1 0 0 0\n 36 40 1 0 0 0\n 37 40 1 0 0 0\n 36 41 1 0 0 0\n 37 42 1 0 0 0\n 43 45 1 0 0 0\n 45 44 1 0 0 0\n 44 46 1 0 0 0\n 46 43 1 0 0 0\n 43 47 1 0 0 0\n 44 47 1 0 0 0\n 43 48 1 0 0 0\n 44 49 1 0 0 0\n 50 52 1 0 0 0\n 52 51 1 0 0 0\n 51 53 1 0 0 0\n 53 50 1 0 0 0\n 50 54 1 0 0 0\n 51 54 1 0 0 0\n 50 55 1 0 0 0\n 51 56 1 0 0 0\n 57 59 1 0 0 0\n 59 58 1 0 0 0\n 58 60 1 0 0 0\n 60 57 1 0 0 0\n 57 61 1 0 0 0\n 58 61 1 0 0 0\n 57 62 1 0 0 0\n 58 63 1 0 0 0\n 64 66 1 0 0 0\n 66 65 1 0 0 0\n 65 67 1 0 0 0\n 67 64 1 0 0 0\n 64 68 1 0 0 0\n 65 68 1 0 0 0\n 64 69 1 0 0 0\n 65 70 1 0 0 0\nM CHG 8 6 -1 7 -1 8 -2 9 -1 10 1 11 3 12 -1 13 2\nM CHG 8 14 2 15 3 16 3 17 3 18 3 19 3 20 3 21 3\nM CHG 8 22 3 23 1 24 1 25 -2 26 -2 27 -2 28 -2 34 -1\nM CHG 8 35 -1 41 -1 42 -1 48 -1 49 -1 55 -1 56 -1 62 -1\nM CHG 3 63 -1 69 -1 70 -1\nM STY 8 1 MUL 2 MUL 3 MUL 4 MUL 5 GEN 6 DAT 7 GEN 8 DAT\nM STY 4 9 GEN 10 DAT 11 GEN 12 DAT\nM SLB 8 1 1 2 2 3 3 4 4 5 5 6 6 7 7 8 8\nM SLB 4 9 9 10 10 11 11 12 12\nM SCN 4 1 HT 2 HT 3 HT 4 HT\nM SAL 1 15 1 2 3 4 5 6 7 29 30 31 32 33 34 35 36\nM SAL 1 15 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51\nM SAL 1 15 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66\nM SAL 1 4 67 68 69 70\nM SPA 1 7 1 2 3 4 5 6 7\nM SMT 1 7\nM SDI 1 4 14.0278 -16.8882 14.0278 -13.0867\nM SDI 1 4 20.5504 -13.0867 20.5504 -16.8882\nM SAL 2 5 8 25 26 27 28\nM SPA 2 1 8\nM SMT 2 5\nM SDI 2 4 11.8250 -11.0444 11.8250 -9.4285\nM SDI 2 4 13.6132 -9.4285 13.6132 -11.0444\nM SAL 3 3 10 23 24\nM SPA 3 1 10\nM SMT 3 3\nM SDI 3 4 4.3788 -11.2007 4.3788 -9.6160\nM SDI 3 4 5.9635 -9.6160 5.9635 -11.2007\nM SAL 4 9 11 15 16 17 18 19 20 21 22\nM SPA 4 1 11\nM SMT 4 9\nM SDI 4 4 7.6600 -11.0757 7.6600 -9.4910\nM SDI 4 4 9.4886 -9.4910 9.4886 -11.0757\nM SAL 5 1 9\nM SDI 5 4 15.4214 -10.9507 15.4214 -9.3660\nM SDI 5 4 16.9657 -9.3660 16.9657 -10.9507\nM SDT 6 FDAREG_SGROUP\nM SDD 6 1.2813 0.0625 DR ALL 1 6\nM SED 6 A\nM SAL 7 1 12\nM SDI 7 4 18.4500 -10.8257 18.4500 -9.2098\nM SDI 7 4 20.4006 -9.2098 20.4006 -10.8257\nM SDT 8 FDAREG_SGROUP\nM SDD 8 1.2813 -0.0625 DR ALL 1 6\nM SED 8 B\nM SAL 9 1 13\nM SDI 9 4 4.4701 -15.6694 4.4701 -14.0848\nM SDI 9 4 6.5174 -14.0848 6.5174 -15.6694\nM SDT 10 FDAREG_SGROUP\nM SDD 10 1.2813 -0.2500 DR ALL 1 6\nM SED 10 C\nM SAL 11 1 14\nM SDI 11 4 8.0151 -15.7319 8.0151 -14.1473\nM SDI 11 4 9.9687 -14.1473 9.9687 -15.7319\nM SDT 12 FDAREG_SGROUP\nM SDD 12 1.3750 0.0625 DR ALL 1 6\nM SED 12 D\nM SPL 4 6 5 8 7 10 9 12 11\nM END", "smiles": "[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[F-].[Fe+2].[K+].[K+].[K+].[Mg+2].[O-][Si]12O[Si]([O-])(O1)O2.[O-][Si]12O[Si]([O-])(O1)O2.[O-][Si]12O[Si]([O-])(O1)O2.[O-][Si]12O[Si]([O-])(O1)O2.[O-][Si]12O[Si]([O-])(O1)O2.[O-][Si]12O[Si]([O-])(O1)O2.[O-][Si]12O[Si]([O-])(O1)O2.[OH-].[O-2].[O-2].[O-2].[O-2].[O-2]", "formula": "9Al.F.Fe.3K.Mg.5O.7O5Si2.HO", "atropisomerism": "No", "charge": 8, "count": 1, "stereochemistry": "ACHIRAL", "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "1509.4563", "optical_activity": "NONE", "references": [ "8302fc98-adc7-4745-98a5-ea88fcfb6e97", "cab0ce97-bd25-48da-b2fa-b85e8574d9f7" ], "stereo_centers": 14 }, "unii": "D7BC5B0F46" } ] }