Vitas-M small molecule compound
(2E)-3-[1-(2-hydroxy-3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}propyl)-1H-indol-3-yl]-1-(4-methoxyphenyl)prop-2-en-1-one
Catalog ID
STL440663
SMILES COc1ccc(cc1)C(=O)/C=C/c1cn(c2c1cccc2)CC(CNCCc1c[nH]c2c1cc(OC)cc2)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 C32H33N3O4 MW 523.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O4/c1-38-26-10-7-22(8-11-26)32(37)14-9-24-20-35(31-6-4-3-5-28(24)31)21-25(36)19-33-16-15-23-18-34-30-13-12-27(39-2)17-29(23)30/h3-14,17-18,20,25,33-34,36H,15-16,19,21H2,1-2H3/b14-9+InChIKey
WBWBHSRDAFPYAV-NTEUORMPSA-NSynonyms
(2E)3(1(2hydroxy3((2(5methoxy1Hindol3yl)ethyl)amino)propyl)1Hindol3yl)1(4methoxyphenyl)prop2en1one
(E)3(1(2hydroxy3(2(5methoxy1Hindol3yl)ethylamino)propyl)indol3yl)1(4methoxyphenyl)prop2en1one
COC1=CC=C(C=C1)C(=O)C=CC2=CN(C3=CC=CC=C32)CC(CNCCC4=CNC5=C4C=C(C=C5)OC)O
COc1ccc(cc1)C(=O)C=Cc1cn(c2c1cccc2)CC(CNCCc1c(nH)c2c1cc(OC)cc2)O
InChI=1SC32H33N3O4c1382610722(81126)32(37)149242035(31643528(24)31)2125(36)1933161523183430131227(392)1729(23)30h31417182025333436H15161921H212H3b149+
MFCD08273266
ZINC000008757880
ZINC000008757883
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