Vitas-M small molecule compound
methyl 4-[(3E)-1-(furan-2-ylmethyl)-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-4,5-dioxopyrrolidin-2-yl]benzoate
Catalog ID
STK605136
SMILES COC(=O)c1ccc(cc1)C1N(Cc2ccco2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/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 C32H27NO7 MW 537.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27NO7/c1-20-5-3-6-21(17-20)19-40-25-14-12-23(13-15-25)29(34)27-28(22-8-10-24(11-9-22)32(37)38-2)33(31(36)30(27)35)18-26-7-4-16-39-26/h3-17,28,34H,18-19H2,1-2H3/b29-27+InChIKey
KEJYOAKKHMJGBW-ORIPQNMZSA-NSynonyms
799832-02-3799832023
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=CO4)C5=CC=C(C=C5)C(=O)OC)O
COC(=O)c1ccc(cc1)C1N(Cc2ccco2)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC32H27NO7c12053621(1720)194025141223(131525)29(34)2728(2281024(11922)32(37)382)33(31(36)30(27)35)182674163926h3172834H1819H212H3b2927+
methyl4((3E)1(furan2ylmethyl)3(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)45dioxopyrrolidin2yl)benzoate
METHYL4((3E)1(FURAN2YLMETHYL)3(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)45DIOXOPYRROLIDIN2YL)BENZOATE
MFCD08733988
ZINC000102698257
ZINC000102698262
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