{ "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": "6b440abb-c888-427b-aa55-ed0019652dfe", "code": "64849-39-4", "type": "PRIMARY", "url": "https://commonchemistry.cas.org/detail?cas_rn=64849-39-4", "code_system": "CAS", "references": [ "9948b69f-f777-4341-b339-352bb5ef38c0", "d2830aaf-99f9-466e-8075-b9c53df86ac2" ] }, { "uuid": "35df03ad-f764-4239-bcd7-0ebbdaa74ede", "code": "C056177", "type": "PRIMARY", "url": "http://www.ncbi.nlm.nih.gov/mesh/67056177", "code_system": "MESH", "references": [ "9948b69f-f777-4341-b339-352bb5ef38c0" ] }, { "uuid": "66139271-263a-4456-a110-bd00a613bc6b", "code": "24721373", "type": "PRIMARY", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/24721373", "code_system": "PUBCHEM", "references": [ "9948b69f-f777-4341-b339-352bb5ef38c0" ] }, { "uuid": "a2f8ad10-d357-4083-8240-94d9bb36f835", "code": "TCV5K3M3GX", "type": "PRIMARY", "code_system": "FDA UNII" }, { "uuid": "5c9d8403-72c2-98ec-c0b5-c82078f70267", "code": "145021", "type": "PRIMARY", "url": "https://www.ebi.ac.uk/chebi/chebiOntology.do?chebiId=CHEBI:145021", "code_system": "CHEBI", "references": [ "2a7260d0-0071-9934-ef9c-92923bc22e3f" ] }, { "uuid": "94925ab7-5816-3677-73d8-6c2057d0ae8f", "code": "DTXSID10983436", "type": "PRIMARY", "url": "https://comptox.epa.gov/dashboard/chemical/details/DTXSID10983436", "code_system": "EPA CompTox", "references": [ "5c8eac43-56f8-0b27-1691-e0dce37d4fa9" ] }, { "uuid": "427cfbd5-fe12-9173-99d6-4ec9e341318f", "code": "100000182014", "type": "PRIMARY", "code_system": "SMS_ID", "references": [ "a65deb78-a740-0c42-5081-db8987cad979" ] } ], "relationships": [ { "uuid": "332ff455-9784-4732-8a27-0e78819a6b30", "type": "PARENT->CONSTITUENT ALWAYS PRESENT", "references": [ "f7dc17b5-f4d6-485f-85cf-0e08a4dc6d62" ], "related_substance": { "uuid": "97f8a3a7-0d70-45a3-bb39-d2130e3d0c31", "refuuid": "9de3c1b3-dd78-4d38-9230-990ef6702535", "name": "STEVIA REBAUDIANA LEAF", "unii": "6TC6NN0876", "linking_id": "6TC6NN0876", "ref_pname": "STEVIA REBAUDIANA LEAF", "substance_class": "reference" } }, { "uuid": "feb5ae0d-29ad-47d2-b124-b0d6f7d36774", "comments": "Isolated stevia sweetener, produced by the extraction of STEVIA REBAUDIANA leaves by hot water and powdering.", "type": "PARENT->CONSTITUENT ALWAYS PRESENT", "references": [ "9a963d71-3071-49a0-af0f-1c5c4920f2a0" ], "related_substance": { "uuid": "7bbcc169-f5b9-4a28-9a2f-a1a7fff25c13", "refuuid": "9de3c1b3-dd78-4d38-9230-990ef6702535", "name": "STEVIA REBAUDIANA LEAF", "unii": "6TC6NN0876", "linking_id": "6TC6NN0876", "ref_pname": "STEVIA REBAUDIANA LEAF", "substance_class": "reference" } } ], "substance_class": "chemical", "names": [ { "uuid": "260d239c-c469-4494-bd66-4f1252bc6066", "name": "KAUR-16-EN-18-OIC ACID, 13-(.BETA.-D-GLUCOPYRANOSYLOXY)-, .BETA.-D-GLUCOPYRANOSYL ESTER, (4.ALPHA.)-", "stdName": "KAUR-16-EN-18-OIC ACID, 13-(.BETA.-D-GLUCOPYRANOSYLOXY)-, .BETA.-D-GLUCOPYRANOSYL ESTER, (4.ALPHA.)-", "type": "cn", "languages": [ "en" ], "preferred": false, "references": [ "c63ac3a3-4fd4-4184-92fd-18b9785ed314", "e72e2c55-0b41-492b-971a-2ebb48619171" ], "display_name": false }, { "uuid": "2ea67c37-41a2-4e51-9635-056a5fb4a252", "name": "RUB", "stdName": "RUB", "type": "cn", "languages": [ "en" ], "preferred": false, "references": [ "72d28416-4629-4183-9e3b-22e77ce26779", "c63ac3a3-4fd4-4184-92fd-18b9785ed314" ], "display_name": false }, { "uuid": "2a54f39e-f2a4-40a4-bf58-711ab56636fa", "name": "RUBUSOSIDE", "stdName": "RUBUSOSIDE", "type": "of", "languages": [ "en" ], "preferred": false, "references": [ "aeff9919-f6bb-4f6f-b745-a43de846fcaf", "88418c8a-5cbc-4928-a804-cf4bf84798b5", "f8eadf85-5dc4-4a97-993e-8f55a077285c", "c63ac3a3-4fd4-4184-92fd-18b9785ed314", "ee70f01b-784a-4406-8b1b-5561278ec7d9" ], "display_name": true, "domains": [ "cosmetic" ], "name_orgs": [ { "uuid": "af32f257-5cd2-44e9-9b80-fa55fc865605", "name_org": "INCI" } ] } ], "references": [ { "uuid": "88418c8a-5cbc-4928-a804-cf4bf84798b5", "citation": "PCPC-DB", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN", "PUBLIC_DOMAIN_RELEASE", "AUTO_SELECTED" ] }, { "uuid": "c63ac3a3-4fd4-4184-92fd-18b9785ed314", "citation": "PERSONAL CARE PRODUCTS COUNCIL", "doc_type": "PERSONAL CARE PRODUCTS COUNCIL", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "e72e2c55-0b41-492b-971a-2ebb48619171", "citation": "STN", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "aeff9919-f6bb-4f6f-b745-a43de846fcaf", "citation": "USP/NF", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "72d28416-4629-4183-9e3b-22e77ce26779", "citation": "http://www.tandfonline.com/doi/pdf/10.1080/19440049.2013.843101", "url": "http://www.tandfonline.com/doi/pdf/10.1080/19440049.2013.843101", "doc_type": "SRS", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "9948b69f-f777-4341-b339-352bb5ef38c0", "citation": "SRS CODE IMPORT", "doc_type": "SRS", "public_domain": true, "document_date": 1493391600000, "tags": [ "NOMEN" ] }, { "uuid": "f7dc17b5-f4d6-485f-85cf-0e08a4dc6d62", "citation": "WOELER RIECK, U ET AL, THE LEAVES OF STEVIA REBAUDIANA (BERTONI), THEIR CONSTITUENTS AND THE ANALYSES THEREOF: A REVIEW , JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 60(4)886-895, 2012", "url": "http://pubs.acs.org/doi/pdf/10.1021/jf2044907", "doc_type": "JOURNAL ARTICLE", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "9a963d71-3071-49a0-af0f-1c5c4920f2a0", "citation": "KAKIGI, Y ET AL, CLASSIFICATION OF STEVIA SWEETENERS IN SOFT DRINKS USING LIQUID CHROMATOGRAPHY AND TIME-OF-FLIGHT MASS SPECTROMETRY, FOOD ADDITIVES & CONTAMINANTS. PART A., 30(12)2043-2049, 2013", "url": "http://www.tandfonline.com/doi/pdf/10.1080/19440049.2013.843101", "doc_type": "JOURNAL ARTICLE", "public_domain": true, "tags": [ "NOMEN" ] }, { "uuid": "e936bb3c-df78-41d2-b455-bd43c63fbc75", "citation": "SRS import [TCV5K3M3GX]", "url": "http://fdasis.nlm.nih.gov/srs/srsdirect.jsp?regno=TCV5K3M3GX", "doc_type": "SRS", "public_domain": true, "document_date": 1493391600000, "tags": [ "NOMEN" ] }, { "uuid": "f8eadf85-5dc4-4a97-993e-8f55a077285c", "citation": "RUBUSOSIDE [INCI]", "doc_type": "SRS_LOCATOR", "public_domain": true }, { "uuid": "ee70f01b-784a-4406-8b1b-5561278ec7d9", "citation": "RUBUSOSIDE [USP-RS]", "doc_type": "SRS_LOCATOR", "public_domain": true }, { "uuid": "d2830aaf-99f9-466e-8075-b9c53df86ac2", "citation": "STN", "doc_type": "STN (SCIFINDER)", "public_domain": true }, { "uuid": "2a7260d0-0071-9934-ef9c-92923bc22e3f", "doc_type": "SYSTEM", "public_domain": true }, { "uuid": "5c8eac43-56f8-0b27-1691-e0dce37d4fa9", "citation": "EPA CompTox", "doc_type": "EPA", "public_domain": true }, { "uuid": "a65deb78-a740-0c42-5081-db8987cad979", "citation": "EU-SRS", "doc_type": "EMA LIST", "public_domain": true } ], "definition_type": "PRIMARY", "moieties": [ { "uuid": "32f0a8ae-b097-45ff-bdc2-fc7bc2319550", "id": "32f0a8ae-b097-45ff-bdc2-fc7bc2319550", "molfile": "\n Marvin 01132102432D \n\n 45 50 0 0 1 0 999 V2000\n 5.2892 -7.9078 0.0000 C 0 0 1 0 0 0 0 0 0 1 0 0\n 4.5933 -7.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.8616 -7.8455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.0209 -7.5269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7167 -7.9701 0.0000 C 0 0 1 0 0 0 0 0 0 2 0 0\n 7.4485 -7.5892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 7.4845 -6.7649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2163 -6.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7887 -6.3217 0.0000 C 0 0 2 0 0 0 0 0 0 1 0 0\n 6.7527 -7.1459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.9707 -6.4294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4685 -5.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.7842 -5.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.6022 -4.9050 0.0000 C 0 0 1 0 0 0 0 0 0 2 0 0\n 6.0999 -4.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.9178 -4.1428 0.0000 C 0 0 2 0 0 0 0 0 0 1 0 0\n 6.4156 -3.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7313 -2.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.5493 -2.6184 0.0000 C 0 0 2 0 0 0 0 0 0 2 0 0\n 7.2336 -3.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.7358 -4.0351 0.0000 C 0 0 1 0 0 0 0 0 0 1 0 0\n 8.4749 -3.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.3672 -2.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.9506 -2.1427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2381 -4.6896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.9223 -5.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.1044 -5.5595 0.0000 C 0 0 2 0 0 0 0 0 0 2 0 0\n 7.5493 -1.7934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.8348 -1.3809 0.0000 C 0 0 2 0 0 0 0 0 0 2 0 0\n 6.8348 -0.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1204 -0.1434 0.0000 C 0 0 2 0 0 0 0 0 0 1 0 0\n 6.1204 0.6816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4059 1.0941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4059 -0.5559 0.0000 C 0 0 1 0 0 0 0 0 0 2 0 0\n 4.6914 -0.1434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4059 -1.3809 0.0000 C 0 0 2 0 0 0 0 0 0 2 0 0\n 4.6914 -1.7934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1204 -1.7934 0.0000 C 0 0 1 0 0 0 0 0 0 1 0 0\n 6.1204 -2.6184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.6807 -8.7943 0.0000 C 0 0 2 0 0 0 0 0 0 1 0 0\n 7.3765 -9.2376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.9490 -9.1753 0.0000 C 0 0 1 0 0 0 0 0 0 2 0 0\n 5.9130 -9.9995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.2532 -8.7320 0.0000 C 0 0 2 0 0 0 0 0 0 2 0 0\n 4.5214 -9.1129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 1 2 1 1 0 0 0\n 1 4 1 0 0 0 0\n 44 1 1 0 0 0 0\n 2 3 1 0 0 0 0\n 5 4 1 0 0 0 0\n 5 6 1 1 0 0 0\n 40 5 1 0 0 0 0\n 7 6 1 0 0 0 0\n 7 8 2 0 0 0 0\n 9 7 1 0 0 0 0\n 9 10 1 1 0 0 0\n 9 11 1 0 0 0 0\n 27 9 1 0 0 0 0\n 11 12 1 0 0 0 0\n 12 13 1 0 0 0 0\n 14 13 1 0 0 0 0\n 14 15 1 6 0 0 0\n 16 14 1 0 0 0 0\n 14 27 1 0 0 0 0\n 16 17 1 6 0 0 0\n 21 16 1 0 0 0 0\n 18 17 1 0 0 0 0\n 19 18 1 0 0 0 0\n 19 20 1 6 0 0 0\n 23 19 1 0 0 0 0\n 19 28 1 0 0 0 0\n 21 20 1 6 0 0 0\n 21 22 1 0 0 0 0\n 21 25 1 0 0 0 0\n 22 23 1 0 0 0 0\n 23 24 2 0 0 0 0\n 26 25 1 0 0 0 0\n 27 26 1 6 0 0 0\n 29 28 1 1 0 0 0\n 29 30 1 0 0 0 0\n 38 29 1 0 0 0 0\n 31 30 1 0 0 0 0\n 31 32 1 1 0 0 0\n 34 31 1 0 0 0 0\n 32 33 1 0 0 0 0\n 34 35 1 6 0 0 0\n 36 34 1 0 0 0 0\n 36 37 1 1 0 0 0\n 38 36 1 0 0 0 0\n 38 39 1 6 0 0 0\n 40 41 1 6 0 0 0\n 42 40 1 0 0 0 0\n 42 43 1 1 0 0 0\n 44 42 1 0 0 0 0\n 44 45 1 6 0 0 0\nM END", "smiles": "C=C1C[C@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O[C@H]5[C@@H]([C@H]([C@@H]([C@@H](CO)O5)O)O)O)[C@@H]3CC[C@@]1(C2)O[C@H]6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)O)O)O", "formula": "C32H50O13", "atropisomerism": "No", "charge": 0, "count": 1, "stereochemistry": "ABSOLUTE", "count_amount": { "type": "MOL RATIO", "average": 1, "units": "MOL RATIO", "uuid": "3ab7463d-2302-4701-98d2-1a2e3c4f0fc1" }, "defined_stereo": 16, "ez_centers": 0, "molecular_weight": "642.7329", "optical_activity": "UNSPECIFIED", "stereo_centers": 16 } ], "definition_level": "COMPLETE", "uuid": "dcfd8431-bda3-4b59-acc3-db06e7d372db", "version": "10", "structure": { "id": "ad3dbbcf-3d3d-4674-8f30-3943e26bd918", "molfile": "\n Marvin 01132108592D \n\n 47 52 0 0 1 0 999 V2000\n 6.7167 -7.9701 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 7.4485 -7.5892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 7.4845 -6.7649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2163 -6.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7887 -6.3217 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 6.7527 -7.1459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.9707 -6.4294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4685 -5.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.7842 -5.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.6022 -4.9050 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 6.0999 -4.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.1044 -5.5595 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 7.6066 -6.2140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 7.9223 -5.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2381 -4.6896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.7358 -4.0351 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 7.2336 -3.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.5493 -2.6184 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 7.5493 -1.7934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.8348 -1.3809 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 6.8348 -0.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1204 -0.1434 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 6.1204 0.6816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4059 1.0941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4059 -0.5559 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 4.6914 -0.1434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4059 -1.3809 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 4.6914 -1.7934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1204 -1.7934 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 6.1204 -2.6184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.7313 -2.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.4156 -3.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.9178 -4.1428 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 7.4201 -4.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 8.3672 -2.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.9506 -2.1427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 8.4749 -3.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.6807 -8.7943 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 7.3765 -9.2376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.9490 -9.1753 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 5.9130 -9.9995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.2532 -8.7320 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0\n 4.5214 -9.1129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.2892 -7.9078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0\n 4.5933 -7.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.8616 -7.8455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.0209 -7.5269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 1 2 1 1 0 0 0\n 3 2 1 0 0 0 0\n 3 4 2 0 0 0 0\n 5 3 1 0 0 0 0\n 5 6 1 1 0 0 0\n 7 5 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 6 0 0 0\n 12 10 1 0 0 0 0\n 12 13 1 1 0 0 0\n 12 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 6 0 0 0\n 18 17 1 6 0 0 0\n 18 19 1 0 0 0 0\n 20 19 1 1 0 0 0\n 20 21 1 0 0 0 0\n 21 22 1 0 0 0 0\n 22 23 1 1 0 0 0\n 23 24 1 0 0 0 0\n 25 22 1 0 0 0 0\n 25 26 1 6 0 0 0\n 25 27 1 0 0 0 0\n 27 28 1 1 0 0 0\n 27 29 1 0 0 0 0\n 29 30 1 6 0 0 0\n 29 20 1 0 0 0 0\n 18 31 1 0 0 0 0\n 31 32 1 0 0 0 0\n 33 32 1 0 0 0 0\n 33 34 1 1 0 0 0\n 16 33 1 0 0 0 0\n 33 10 1 0 0 0 0\n 35 18 1 0 0 0 0\n 35 36 2 0 0 0 0\n 37 35 1 0 0 0 0\n 16 37 1 0 0 0 0\n 5 12 1 0 0 0 0\n 38 1 1 0 0 0 0\n 38 39 1 6 0 0 0\n 40 38 1 0 0 0 0\n 40 41 1 1 0 0 0\n 42 40 1 0 0 0 0\n 42 43 1 6 0 0 0\n 42 44 1 0 0 0 0\n 44 45 1 1 0 0 0\n 45 46 1 0 0 0 0\n 47 44 1 0 0 0 0\n 1 47 1 0 0 0 0\nM END", "smiles": "C=C1C[C@]23CC[C@@]4([H])[C@@](C)(CCC[C@@]4(C)C(=O)O[C@H]5[C@@H]([C@H]([C@@H]([C@@H](CO)O5)O)O)O)[C@]3([H])CC[C@@]1(C2)O[C@H]6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)O)O)O", "formula": "C32H50O13", "atropisomerism": "No", "charge": 0, "count": 1, "stereochemistry": "ABSOLUTE", "defined_stereo": 16, "ez_centers": 0, "molecular_weight": "642.7329", "optical_activity": "UNSPECIFIED", "references": [ "e936bb3c-df78-41d2-b455-bd43c63fbc75", "e72e2c55-0b41-492b-971a-2ebb48619171" ], "stereo_centers": 16 }, "unii": "TCV5K3M3GX" } ] }