Vitas-M small molecule compound
3-(2,3-dimethoxyphenyl)-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STL193012
SMILES COc1c(OC)cccc1C1NC(C2C1C(=O)N(C2=O)c1ccccc1)C(=O)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 C21H20N2O6 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6/c1-28-13-10-6-9-12(18(13)29-2)16-14-15(17(22-16)21(26)27)20(25)23(19(14)24)11-7-4-3-5-8-11/h3-10,14-17,22H,1-2H3,(H,26,27)InChIKey
QCWJMPPMCUCZPH-UHFFFAOYSA-NSynonyms
1(23dimethoxyphenyl)46dioxo5phenyl233a6atetrahydro1Hpyrrolo(34c)pyrrole3carboxylicacid
3(23dimethoxyphenyl)46dioxo5phenyloctahydropyrrolo(34c)pyrrole1carboxylicacid
COC1=CC=CC(=C1OC)C2C3C(C(N2)C(=O)O)C(=O)N(C3=O)C4=CC=CC=C4
InChI=1SC21H20N2O6c12813106912(18(13)292)161415(17(2216)21(26)27)20(25)23(19(14)24)117435811h310141722H12H3(H2627)
MFCD22390840
ZINC000106937949
ZINC000248138827
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