Vitas-M small molecule compound
(8xi,9xi,14xi)-17-({[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}methyl)androstan-17-ol
Catalog ID
STL528192
SMILES Brc1ccc(c(c1)/C=N/CC1(O)CCC2[C@]1(C)CCC1C2CCC2[C@]1(C)CCCC2)O
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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 C27H38BrNO2 MW 488.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38BrNO2/c1-25-12-4-3-5-19(25)6-8-21-22(25)10-13-26(2)23(21)11-14-27(26,31)17-29-16-18-15-20(28)7-9-24(18)30/h7,9,15-16,19,21-23,30-31H,3-6,8,10-14,17H2,1-2H3/b29-16+/t19?,21?,22?,23?,25-,26-,27?/m0/s1InChIKey
NLXAIRBLZJOAOY-IRDIWGPFSA-NSynonyms
(10S13S)17(((E)(5bromo2hydroxybenzylidene)amino)methyl)1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17ol
(8xi9xi14xi)17((((E)(5bromo2hydroxyphenyl)methylidene)amino)methyl)androstan17ol
Brc1ccc(c(c1)C=NCC1(O)CCC2(C@)1(C)CCC1C2CCC2(C@)1(C)CCCC2)O
InChI=1SC27H38BrNO2c1251243519(25)682122(25)101326(2)23(21)111427(2631)172916181520(28)7924(18)30h7915161921233031H368101417H212H3b2916+t19?21?22?23?252627?m0s1
MFCD03849978
ZINC000012661703
ZINC000118918871
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