Vitas-M small molecule compound

(4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(2-methoxyethyl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione

Catalog ID
STK605576
SMILES COCCN1C(c2ccc(cc2)OCCC)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\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 C31H33NO6 MW 515.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33NO6/c1-4-17-37-25-12-8-23(9-13-25)28-27(30(34)31(35)32(28)16-18-36-3)29(33)24-10-14-26(15-11-24)38-20-22-7-5-6-21(2)19-22/h5-15,19,28,33H,4,16-18,20H2,1-3H3/b29-27+
InChIKey
AJXAEYNXIMEYTQ-ORIPQNMZSA-N
Synonyms
836641-47-5
(4E)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)1(2methoxyethyl)5(4propoxyphenyl)pyrrolidine23dione
(4E)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(2METHOXYETHYL)5(4PROPOXYPHENYL)PYRROLIDINE23DIONE
836641475
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC4=CC=CC(=C4)C)O)C(=O)C(=O)N2CCOC
COCCN1C(c2ccc(cc2)OCCC)C(=C(c2ccc(cc2)OCc2cccc(c2)C)O)C(=O)C1=O
InChI=1SC31H33NO6c1417372512823(91325)2827(30(34)31(35)32(28)1618363)29(33)24101426(151124)38202275621(2)1922h515192833H4161820H213H3b2927+
MFCD08734675
ZINC000102699109
ZINC000102699118

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Available files

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