Vitas-M small molecule compound

3-(3-ethoxy-2-hydroxyphenyl)-5-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid

Catalog ID
STL094554
SMILES CCOc1cccc(c1O)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)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 C22H22N2O6 MW 410.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O6/c1-3-30-14-6-4-5-13(19(14)25)17-15-16(18(23-17)22(28)29)21(27)24(20(15)26)12-9-7-11(2)8-10-12/h4-10,15-18,23,25H,3H2,1-2H3,(H,28,29)
InChIKey
KZXJWBQRSPEOQL-UHFFFAOYSA-N
Synonyms
1093751-45-1
1(3ethoxy2hydroxyphenyl)5(4methylphenyl)46dioxo233a6atetrahydro1Hpyrrolo(34c)pyrrole3carboxylicacid
1093751451
3(3ethoxy2hydroxyphenyl)5(4methylphenyl)46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CCOC1=CC=CC(=C1O)C2C3C(C(N2)C(=O)O)C(=O)N(C3=O)C4=CC=C(C=C4)C
InChI=1SC22H22N2O6c13301464513(19(14)25)171516(18(2317)22(28)29)21(27)24(20(15)26)129711(2)81012h41015182325H3H212H3(H2829)
MFCD14725905
ZINC000020131130
ZINC000245296176

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Available files

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