Vitas-M small molecule compound
(16E)-16-(1H-pyrrol-2-ylmethylidene)androstan-17-one
Catalog ID
STK524153
SMILES O=C1/C(=C/c2ccc[nH]2)/CC2C1(C)CCC1C2CCC2C1(C)CCCC2
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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 C24H33NO MW 351.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33NO/c1-23-11-4-3-6-17(23)8-9-19-20(23)10-12-24(2)21(19)15-16(22(24)26)14-18-7-5-13-25-18/h5,7,13-14,17,19-21,25H,3-4,6,8-12,15H2,1-2H3/b16-14+InChIKey
XQGICSGOYOKZIM-JQIJEIRASA-NSynonyms
(16E)1013dimethyl16(1Hpyrrol2ylmethylidene)2345678911121415dodecahydro1Hcyclopenta(a)phenanthren17one
(16E)16(1Hpyrrol2ylmethylidene)androstan17one
CC12CCCCC1CCC3C2CCC4(C3CC(=CC5=CC=CN5)C4=O)C
InChI=1SC24H33NOc1231143617(23)891920(23)101224(2)21(19)1516(22(24)26)141875132518h57131417192125H34681215H212H3b1614+
MFCD02041979
O=C1C(=Cc2ccc(nH)2)CC2C1(C)CCC1C2CCC2C1(C)CCCC2
ZINC000118913491
ZINC000245229427
ZINC000253498623
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