Vitas-M small molecule compound
(16Z)-16-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]androstan-17-one
Catalog ID
STK308874
SMILES O=C1/C(=C\c2cnn(c2C)C)/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 C25H36N2O MW 380.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N2O/c1-16-18(15-26-27(16)4)13-17-14-22-20-9-8-19-7-5-6-11-24(19,2)21(20)10-12-25(22,3)23(17)28/h13,15,19-22H,5-12,14H2,1-4H3/b17-13-InChIKey
FHBPPNPYHCJYHP-LGMDPLHJSA-NSynonyms
1041924-53-1(16Z)16((15dimethyl1Hpyrazol4yl)methylidene)androstan17one
(16Z)16((15dimethylpyrazol4yl)methylidene)1013dimethyl2345678911121415dodecahydro1Hcyclopenta(a)phenanthren17one
1041924531
CC1=C(C=NN1C)C=C2CC3C4CCC5CCCCC5(C4CCC3(C2=O)C)C
InChI=1SC25H36N2Oc11618(152627(16)4)131714222098197561124(192)21(20)101225(223)23(17)28h13151922H51214H214H3b1713
MFCD04051203
O=C1C(=Cc2cnn(c2C)C)CC2C1(C)CCC1C2CCC2C1(C)CCCC2
ZINC000253508359
ZINC000253508377
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