Vitas-M small molecule compound
(16E)-16-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]androstane-3,17-diol
Catalog ID
STL401692
SMILES OC1CCC2(C(C1)CCC1C2CCC2(C1C/C(=C\c1c(C)nn(c1C)C)/C2O)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 C26H40N2O2 MW 412.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H40N2O2/c1-15-21(16(2)28(5)27-15)12-17-13-23-20-7-6-18-14-19(29)8-10-25(18,3)22(20)9-11-26(23,4)24(17)30/h12,18-20,22-24,29-30H,6-11,13-14H2,1-5H3/b17-12+InChIKey
IFDSJTUAVYQLDO-SFQUDFHCSA-NSynonyms
(16E)1013dimethyl16((135trimethylpyrazol4yl)methylidene)1234567891112141517tetradecahydrocyclopenta(a)phenanthrene317diol
(16E)16((135trimethyl1Hpyrazol4yl)methylidene)androstane317diol
CC1=C(C(=NN1C)C)C=C2CC3C4CCC5CC(CCC5(C4CCC3(C2O)C)C)O
InChI=1SC26H40N2O2c11521(16(2)28(5)2715)121713232076181419(29)81025(183)22(20)91126(234)24(17)30h12182022242930H6111314H215H3b1712+
MFCD28952604
OC1CCC2(C(C1)CCC1C2CCC2(C1CC(=Cc1c(C)nn(c1C)C)C2O)C)C
ZINC000147166866
ZINC000253534514
ZINC000253534517
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