Vitas-M small molecule compound
5-(4-fluorophenyl)-4,6-dioxo-3-(2,3,4-trimethoxyphenyl)octahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STL193013
SMILES COc1c(ccc(c1OC)OC)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)F)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 C22H21FN2O7 MW 444.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN2O7/c1-30-13-9-8-12(18(31-2)19(13)32-3)16-14-15(17(24-16)22(28)29)21(27)25(20(14)26)11-6-4-10(23)5-7-11/h4-9,14-17,24H,1-3H3,(H,28,29)InChIKey
DJUHLCLAQVXCJB-UHFFFAOYSA-NSynonyms
5(4fluorophenyl)46dioxo1(234trimethoxyphenyl)233a6atetrahydro1Hpyrrolo(34c)pyrrole3carboxylicacid
5(4fluorophenyl)46dioxo3(234trimethoxyphenyl)octahydropyrrolo(34c)pyrrole1carboxylicacid
COC1=C(C(=C(C=C1)C2C3C(C(N2)C(=O)O)C(=O)N(C3=O)C4=CC=C(C=C4)F)OC)OC
InChI=1SC22H21FN2O7c130139812(18(312)19(13)323)161415(17(2416)22(28)29)21(27)25(20(14)26)116410(23)5711h49141724H13H3(H2829)
MFCD14725909
ZINC000020131178
ZINC000245295369
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