Vitas-M small molecule compound
(4E)-1-benzyl-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL149243
SMILES COc1cc(ccc1O)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1Cc1ccccc1
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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 C28H25NO6 MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25NO6/c1-16-12-20-13-19(9-11-22(20)35-16)26(31)24-25(18-8-10-21(30)23(14-18)34-2)29(28(33)27(24)32)15-17-6-4-3-5-7-17/h3-11,13-14,16,25,30-31H,12,15H2,1-2H3/b26-24+InChIKey
BPOBECBDBALHPW-SHHOIMCASA-NSynonyms
(4E)1benzyl5(4hydroxy3methoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=CC=C4)C5=CC(=C(C=C5)O)OC)O
COc1cc(ccc1O)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC28H25NO6c11612201319(91122(20)3516)26(31)2425(1881021(30)23(1418)342)29(28(33)27(24)32)15176435717h311131416253031H1215H212H3b2624+
MFCD04073407
ZINC000102928941
ZINC000102928947
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