Vitas-M small molecule compound
(16Z)-16-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]androstan-17-ol
Catalog ID
STK967694
SMILES CCn1ncc(c1C)/C=C\1/CC2C(C1O)(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 C26H40N2O MW 396.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H40N2O/c1-5-28-17(2)19(16-27-28)14-18-15-23-21-10-9-20-8-6-7-12-25(20,3)22(21)11-13-26(23,4)24(18)29/h14,16,20-24,29H,5-13,15H2,1-4H3/b18-14-InChIKey
WNRWZRXSDMQPIJ-JXAWBTAJSA-NSynonyms
(16Z)16((1ethyl5methyl1Hpyrazol4yl)methylidene)androstan17ol
(16Z)16((1ethyl5methylpyrazol4yl)methylidene)1013dimethyl1234567891112141517tetradecahydrocyclopenta(a)phenanthren17ol
16((1ETHYL5METHYL1HPYRAZOL4YL)METHYLENE)ANDROSTAN17OL
CCN1C(=C(C=N1)C=C2CC3C4CCC5CCCCC5(C4CCC3(C2O)C)C)C
CCn1ncc(c1C)C=C1CC2C(C1O)(C)CCC1C2CCC2C1(C)CCCC2
InChI=1SC26H40N2Oc152817(2)19(162728)1418152321109208671225(203)22(21)111326(234)24(18)29h1416202429H51315H214H3b1814
MFCD03073879
ZINC000253503728
ZINC000253503736
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