Vitas-M small molecule compound

(4E)-4-{[4-(benzyloxy)-2-methylphenyl](hydroxy)methylidene}-1-(3-methoxypropyl)-5-phenylpyrrolidine-2,3-dione

Catalog ID
STK565358
SMILES COCCCN1C(c2ccccc2)/C(=C(/c2ccc(cc2C)OCc2ccccc2)\O)/C(=O)C1=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 C29H29NO5 MW 471.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO5/c1-20-18-23(35-19-21-10-5-3-6-11-21)14-15-24(20)27(31)25-26(22-12-7-4-8-13-22)30(16-9-17-34-2)29(33)28(25)32/h3-8,10-15,18,26,31H,9,16-17,19H2,1-2H3/b27-25+
InChIKey
KZYHYOSBHWSIIJ-IMVLJIQESA-N
Synonyms
496799-22-5
(4E)4((4(benzyloxy)2methylphenyl)(hydroxy)methylidene)1(3methoxypropyl)5phenylpyrrolidine23dione
(4E)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)1(3METHOXYPROPYL)5PHENYLPYRROLIDINE23DIONE
4((4(BENZYLOXY)2METHYLPHENYL)CARBONYL)3HYDROXY1(3METHOXYPROPYL)5PHENYL25DIHYDRO1HPYRROL2ONE
4(4(BENZYLOXY)2METHYLBENZOYL)3HYDROXY1(3METHOXYPROPYL)5PHENYL15DIHYDRO2HPYRROL2ONE
496799225
CC1=C(C=CC(=C1)OCC2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCCOC)C4=CC=CC=C4)O
COCCCN1C(c2ccccc2)C(=C(c2ccc(cc2C)OCc2ccccc2)O)C(=O)C1=O
InChI=1SC29H29NO5c1201823(351921105361121)141524(20)27(31)2526(22127481322)30(16917342)29(33)28(25)32h381015182631H9161719H212H3b2725+
MFCD03809827
ZINC000102534410
ZINC000102534417

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.