Vitas-M small molecule compound

3-(2,4-dihydroxyphenyl)-5-(2-methoxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid

Catalog ID
STK679203
SMILES COc1ccccc1N1C(=O)C2C(C1=O)C(NC2c1ccc(cc1O)O)(C)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 C21H20N2O7 MW 412.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O7/c1-21(20(28)29)16-15(17(22-21)11-8-7-10(24)9-13(11)25)18(26)23(19(16)27)12-5-3-4-6-14(12)30-2/h3-9,15-17,22,24-25H,1-2H3,(H,28,29)
InChIKey
OJCKOGNRPLFIFF-UHFFFAOYSA-N
Synonyms

1(24DIHYDROXYPHENYL)5(2METHOXYPHENYL)3METHYL46DIOXO123A6ATETRAHYDROPYRROLO(34C)PYRROLE3CARBOXYLICACID
3(24dihydroxyphenyl)5(2methoxyphenyl)1methyl46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CC1(C2C(C(N1)C3=C(C=C(C=C3)O)O)C(=O)N(C2=O)C4=CC=CC=C4OC)C(=O)O
InChI=1SC21H20N2O7c121(20(28)29)1615(17(2221)118710(24)913(11)25)18(26)23(19(16)27)12534614(12)302h391517222425H12H3(H2829)
MFCD03408794
ZINC000004594034
ZINC000033713543

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Available files

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