Vitas-M small molecule compound
1-(3,4-dimethoxybenzyl)-3-hydroxy-3-[(3E,5E)-2-oxo-6-phenylhexa-3,5-dien-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK214958
SMILES COc1cc(ccc1OC)CN1c2ccccc2C(C1=O)(O)CC(=O)/C=C/C=C/c1ccccc1
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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 C29H27NO5 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO5/c1-34-26-17-16-22(18-27(26)35-2)20-30-25-15-9-8-14-24(25)29(33,28(30)32)19-23(31)13-7-6-12-21-10-4-3-5-11-21/h3-18,33H,19-20H2,1-2H3/b12-6+,13-7+InChIKey
ADPRWDGGXIKODR-PWHKKFIBSA-NSynonyms
1((34DIMETHOXYPHENYL)METHYL)3HYDROXY3((3E5E)2OXO6PHENYLHEXA35DIENYL)INDOL2ONE
1(34DIMETHOXYBENZYL)3HYDROXY3((3E5E)2OXO6PHENYLHEXA35DIEN1YL)13DIHYDRO2HINDOL2ONE
1(34DIMETHOXYBENZYL)3HYDROXY3(2OXO6PHENYL35HEXADIENYL)13DIHYDRO2HINDOL2ONE
3((3E5E)2OXO6PHENYLHEXA35DIENYL)1((34DIMETHOXYPHENYL)METHYL)3HYDROXYINDOLIN2ONE
COC1=C(C=C(C=C1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C=CC=CC4=CC=CC=C4)O)OC
COc1cc(ccc1OC)CN1c2ccccc2C(C1=O)(O)CC(=O)C=CC=Cc1ccccc1
InChI=1SC29H27NO5c13426171622(1827(26)352)20302515981424(25)29(3328(30)32)1923(31)13761221104351121h31833H1920H212H3b126+137+
MFCD03650692
ZINC000008919061
ZINC000008919066
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