Vitas-M small molecule compound
1-[(8xi,9xi,14xi,16alpha,17alpha)-3-hydroxy-16,17-epoxyandrost-5-en-16-yl]ethanone
Catalog ID
STL525126
SMILES OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3C[C@@]3([C@H]2O3)C(=O)C)C)C1)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 C21H30O3 MW 330.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30O3/c1-12(22)21-11-17-15-5-4-13-10-14(23)6-8-19(13,2)16(15)7-9-20(17,3)18(21)24-21/h4,14-18,23H,5-11H2,1-3H3/t14?,15?,16?,17?,18-,19-,20-,21-/m0/s1InChIKey
AEJAEAUKXCTTKY-RZVKDUKPSA-NSynonyms
1((4~(R)6~(S)7~(S)11~(R))14hydroxy711dimethyl5oxapentacyclo(8800^(27)0^(46)0^(1116))octadec16en4yl)ethanone
1((8xi9xi14xi16alpha17alpha)3hydroxy1617epoxyandrost5en16yl)ethanone
135639023
InChI=1SC21H30O3c112(22)2111171554131014(23)6819(132)16(15)7920(173)18(21)2421h4141823H511H213H3t14?15?16?17?18192021m0s1
MFCD01881939
ZINC000002944362
ZINC001772491552
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