Vitas-M small molecule compound
(16E)-3-hydroxy-16-[(1-methyl-1H-pyrazol-4-yl)methylidene]androstan-17-one
Catalog ID
STL400894
SMILES OC1CCC2(C(C1)CCC1C2CCC2(C1C/C(=C\c1cnn(c1)C)/C2=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 C24H34N2O2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H34N2O2/c1-23-8-6-18(27)12-17(23)4-5-19-20(23)7-9-24(2)21(19)11-16(22(24)28)10-15-13-25-26(3)14-15/h10,13-14,17-21,27H,4-9,11-12H2,1-3H3/b16-10+InChIKey
AKMGOLMVBIBATQ-MHWRWJLKSA-NSynonyms
(16E)3hydroxy1013dimethyl16((1methylpyrazol4yl)methylidene)2345678911121415dodecahydro1Hcyclopenta(a)phenanthren17one
(16E)3hydroxy16((1methyl1Hpyrazol4yl)methylidene)androstan17one
CC12CCC(CC1CCC3C2CCC4(C3CC(=CC5=CN(N=C5)C)C4=O)C)O
InChI=1SC24H34N2O2c1238618(27)1217(23)451920(23)7924(2)21(19)1116(22(24)28)1015132526(3)1415h101314172127H491112H213H3b1610+
MFCD28033962
OC1CCC2(C(C1)CCC1C2CCC2(C1CC(=Cc1cnn(c1)C)C2=O)C)C
ZINC000118934155
ZINC000245238741
ZINC000253534484
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