Vitas-M small molecule compound
4-[(3E)-3-(4-hydroxy-3-methoxybenzylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate
Catalog ID
STL154369
SMILES COc1cc(ccc1O)/C=C/1\CC(=O)N(C1=O)c1ccc(cc1)OC(=O)C
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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 C20H17NO6 MW 367.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO6/c1-12(22)27-16-6-4-15(5-7-16)21-19(24)11-14(20(21)25)9-13-3-8-17(23)18(10-13)26-2/h3-10,23H,11H2,1-2H3/b14-9+InChIKey
OZEMMAFFOCXKDT-NTEUORMPSA-NSynonyms
1324363-23-6(4((3E)3((4hydroxy3methoxyphenyl)methylidene)25dioxopyrrolidin1yl)phenyl)acetate
(E)4(3(4hydroxy3methoxybenzylidene)25dioxopyrrolidin1yl)phenylacetate
1324363236
4((3E)3(4hydroxy3methoxybenzylidene)25dioxopyrrolidin1yl)phenylacetate
CC(=O)OC1=CC=C(C=C1)N2C(=O)CC(=CC3=CC(=C(C=C3)O)OC)C2=O
COc1cc(ccc1O)C=C1CC(=O)N(C1=O)c1ccc(cc1)OC(=O)C
InChI=1SC20H17NO6c112(22)27166415(5716)2119(24)1114(20(21)25)9133817(23)18(1013)262h31023H11H212H3b149+
MFCD19709672
ZINC000071282351
ZINC71282351
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