Vitas-M small molecule compound
(8xi,9xi,14xi,17xi)-14-hydroxy-3-oxocard-20(22)-enolide
Catalog ID
STL566304
SMILES O=C1CC[C@]2(C(C1)CCC1C2CC[C@]2(C1(O)CCC2C1=CC(=O)OC1)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H32O4 MW 372.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15,17-19,26H,3-10,12-13H2,1-2H3/t15?,17?,18?,19?,21-,22+,23?/m0/s1InChIKey
REJBTXQSIQFRRE-DARAZNSESA-NSynonyms
(8xi9xi14xi17xi)14hydroxy3oxocard20(22)enolide
23963785
3((10S13R)14hydroxy1013dimethyl3oxo24567891112151617dodecahydro1Hcyclopenta(a)phenanthren17yl)2Hfuran5one
4((8R10S13R14S17R)14hydroxy1013dimethyl3oxohexadecahydro1Hcyclopenta(a)phenanthren17yl)furan2(5H)one
InChI=1SC23H32O4c1218516(24)1215(21)341918(21)6922(2)17(71023(1922)26)141120(25)271314h1115171926H3101213H212H3t15?17?18?19?2122+23?m0s1
O=C1CC(C@)2(C(C1)CC(C@@H)1C2CC(C@)2((C@)1(O)CC(C@@H)2C1=CC(=O)OC1)C)C
ZINC000004063408
ZINC001848443857
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