Vitas-M small molecule compound

(4E)-5-(4-hydroxy-3-methoxyphenyl)-4-{hydroxy[3-methyl-4-(2-methylpropoxy)phenyl]methylidene}-1-(3-methoxypropyl)pyrrolidine-2,3-dione

Catalog ID
STL046457
SMILES COCCCN1C(c2ccc(c(c2)OC)O)/C(=C(/c2ccc(c(c2)C)OCC(C)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 C27H33NO7 MW 483.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO7/c1-16(2)15-35-21-10-8-19(13-17(21)3)25(30)23-24(18-7-9-20(29)22(14-18)34-5)28(11-6-12-33-4)27(32)26(23)31/h7-10,13-14,16,24,29-30H,6,11-12,15H2,1-5H3/b25-23+
InChIKey
MOOGHVZFWDDXSC-WJTDDFOZSA-N
Synonyms
488851-54-3
(4E)5(4hydroxy3methoxyphenyl)4(hydroxy(3methyl4(2methylpropoxy)phenyl)methylidene)1(3methoxypropyl)pyrrolidine23dione
3HYDROXY5(4HYDROXY3METHOXYPHENYL)4(4ISOBUTOXY3METHYLBENZOYL)1(3METHOXYPROPYL)15DIHYDRO2HPYRROL2ONE
488851543
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCCOC)C3=CC(=C(C=C3)O)OC)O)OCC(C)C
COCCCN1C(c2ccc(c(c2)OC)O)C(=C(c2ccc(c(c2)C)OCC(C)C)O)C(=O)C1=O
InChI=1SC27H33NO7c116(2)15352110819(1317(21)3)25(30)2324(187920(29)22(1418)345)28(11612334)27(32)26(23)31h710131416242930H6111215H215H3b2523+
MFCD03801072
ZINC000102880850
ZINC000102880851

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Available files

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