Vitas-M small molecule compound
(5alpha,8xi,9xi,14xi)-17-oxoandrostan-3-yl butanoate
Catalog ID
STL526639
SMILES CCCC(=O)OC1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CCC2=O)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 C23H36O3 MW 360.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H36O3/c1-4-5-21(25)26-16-10-12-22(2)15(14-16)6-7-17-18-8-9-20(24)23(18,3)13-11-19(17)22/h15-19H,4-14H2,1-3H3/t15-,16?,17?,18?,19?,22-,23-/m0/s1InChIKey
ZBPQBCXWLUSWGS-INDXKNNZSA-NSynonyms
((5~(S)10~(S)13~(S))1013dimethyl17oxo1234567891112141516tetradecahydrocyclopenta(a)phenanthren3yl)butanoate
(3S5S8R9S10S13S14S)1013dimethyl17oxohexadecahydro1Hcyclopenta(a)phenanthren3ylbutyrate
(5alpha8xi9xi14xi)17oxoandrostan3ylbutanoate
135639181
CCCC(=O)O(C@H)1CC(C@)2((C@H)(C1)CC(C@@H)1(C@@H)2CC(C@)2((C@H)1CCC2=O)C)C
InChI=1SC23H36O3c14521(25)2616101222(2)15(1416)6717188920(24)23(183)131119(17)22h1519H414H213H3t1516?17?18?19?2223m0s1
MFCD03006437
ZINC000504185416
ZINC001772492497
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