Vitas-M small molecule compound
(2Z)-2-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-17-hydroxyandrostan-3-one
Catalog ID
STL401676
SMILES Cn1cc(c(n1)C)/C=C\1/CC2(C)C(CC1=O)CCC1C2CCC2(C1CCC2O)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 C25H36N2O2 MW 396.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N2O2/c1-15-17(14-27(4)26-15)11-16-13-25(3)18(12-22(16)28)5-6-19-20-7-8-23(29)24(20,2)10-9-21(19)25/h11,14,18-21,23,29H,5-10,12-13H2,1-4H3/b16-11-InChIKey
YRSVSKDJZCUHAF-WJDWOHSUSA-NSynonyms
(2Z)2((13dimethyl1Hpyrazol4yl)methylidene)17hydroxyandrostan3one
(2Z)2((13dimethylpyrazol4yl)methylidene)17hydroxy1013dimethyl456789111214151617dodecahydro1Hcyclopenta(a)phenanthren3one
CC1=NN(C=C1C=C2CC3(C(CCC4C3CCC5(C4CCC5O)C)CC2=O)C)C
Cn1cc(c(n1)C)C=C1CC2(C)C(CC1=O)CCC1C2CCC2(C1CCC2O)C
InChI=1SC25H36N2O2c11517(1427(4)2615)11161325(3)18(1222(16)28)5619207823(29)24(202)10921(19)25h111418212329H5101213H214H3b1611
MFCD08557451
ZINC000118916354
ZINC000253505534
ZINC000253505547
Check stock
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