Vitas-M small molecule compound
(5alpha,8xi,9xi,14xi,17Z)-17-(hydroxyimino)androstan-3-yl acetate
Catalog ID
STL525665
SMILES O/N=C\1/CCC2[C@]1(C)CCC1C2CC[C@@H]2[C@]1(C)CCC(C2)OC(=O)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 C21H33NO3 MW 347.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H33NO3/c1-13(23)25-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(22-24)21(17,3)11-9-18(16)20/h14-18,24H,4-12H2,1-3H3/b22-19-/t14-,15?,16?,17?,18?,20-,21-/m0/s1InChIKey
MAIMKJVHBJVMBS-AOXHGGIHSA-NSynonyms
((5~(S)10~(S)13~(S)17~(Z))17hydroxyimino1013dimethyl1234567891112141516tetradecahydrocyclopenta(a)phenanthren3yl)acetate
(5alpha8xi9xi14xi17Z)17(hydroxyimino)androstan3ylacetate
(5S10S13SZ)17(hydroxyimino)1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren3ylacetate
16396830
InChI=1SC21H33NO3c113(23)251581020(2)14(1215)4516176719(2224)21(173)11918(16)20h141824H412H213H3b2219t1415?16?17?18?2021m0s1
MFCD02059290
ON=C1CCC2(C@)1(C)CCC1C2CC(C@@H)2(C@)1(C)CCC(C2)OC(=O)C
ZINC000252694553
ZINC000253499682
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