Vitas-M small molecule compound
(4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(3-hydroxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Catalog ID
STK612267
SMILES COCCN1C(c2cccc(c2)O)/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 C28H27NO6 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO6/c1-18-5-3-6-19(15-18)17-35-23-11-9-20(10-12-23)26(31)24-25(21-7-4-8-22(30)16-21)29(13-14-34-2)28(33)27(24)32/h3-12,15-16,25,30-31H,13-14,17H2,1-2H3/b26-24+InChIKey
QJGKFBHQYUROPH-SHHOIMCASA-NSynonyms
839702-11-3(4E)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)5(3hydroxyphenyl)1(2methoxyethyl)pyrrolidine23dione
(4E)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)5(3HYDROXYPHENYL)1(2METHOXYETHYL)PYRROLIDINE23DIONE
839702113
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCOC)C4=CC(=CC=C4)O)O
COCCN1C(c2cccc(c2)O)C(=C(c2ccc(cc2)OCc2cccc(c2)C)O)C(=O)C1=O
InChI=1SC28H27NO6c11853619(1518)17352311920(101223)26(31)2425(2174822(30)1621)29(1314342)28(33)27(24)32h3121516253031H131417H212H3b2624+
MFCD08731264
ZINC000102710213
ZINC000102710220
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