Vitas-M small molecule compound
(8xi,9xi,14xi,17E)-17-{(2E)-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]hydrazinylidene}estra-1,3,5(10)-trien-3-ol
Catalog ID
STK961486
SMILES Oc1ccc2c(c1)CCC1C2CC[C@]2(C1CC/C/2=N\N=C\c1cn(nc1C)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 C24H30N4O MW 390.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O/c1-15-17(14-28(3)27-15)13-25-26-23-9-8-22-21-6-4-16-12-18(29)5-7-19(16)20(21)10-11-24(22,23)2/h5,7,12-14,20-22,29H,4,6,8-11H2,1-3H3/b25-13+,26-23+/t20?,21?,22?,24-/m0/s1InChIKey
QSCIZHIRAXFDOO-PFKOJKSISA-NSynonyms
494220-14-3(13S17E)17((E)(13dimethylpyrazol4yl)methylidenehydrazinylidene)13methyl7891112141516octahydro6Hcyclopenta(a)phenanthren3ol
(8xi9xi14xi17E)17((2E)((13dimethyl1Hpyrazol4yl)methylidene)hydrazinylidene)estra135(10)trien3ol
494220143
CC1=NN(C=C1C=NN=C2CCC3C2(CCC4C3CCC5=C4C=CC(=C5)O)C)C
InChI=1SC24H30N4Oc11517(1428(3)2715)1325262398222164161218(29)5719(16)20(21)101124(2223)2h571214202229H46811H213H3b2513+2623+t20?21?22?24m0s1
MFCD02374351
Oc1ccc2c(c1)CCC1C2CC(C@)2(C1CCC2=NN=Cc1cn(nc1C)C)C
ZINC000005697224
ZINC000105262254
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