Vitas-M small molecule compound

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

Catalog ID
STK593203
SMILES Cc1cccc(c1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c[nH]c2c1cccc2)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 C29H25N3O5 MW 495.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O5/c1-16-7-6-8-18(13-16)32-26(34)23-24(27(32)35)29(28(36)37,31-25(23)20-10-3-5-12-22(20)33)14-17-15-30-21-11-4-2-9-19(17)21/h2-13,15,23-25,30-31,33H,14H2,1H3,(H,36,37)
InChIKey
PMFCFDUUWAOEOT-UHFFFAOYSA-N
Synonyms
1024354-80-0
1((1Hindol3yl)methyl)3(2hydroxyphenyl)46dioxo5(mtolyl)octahydropyrrolo(34c)pyrrole1carboxylicacid
1(2HYDROXYPHENYL)3(1HINDOL3YLMETHYL)5(3METHYLPHENYL)46DIOXO123A6ATETRAHYDROPYRROLO(34C)PYRROLE3CARBOXYLICACID
1024354800
3(2hydroxyphenyl)1(1Hindol3ylmethyl)5(3methylphenyl)46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
CC1=CC(=CC=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC=CC=C4O)(CC5=CNC6=CC=CC=C65)C(=O)O
Cc1cccc(c1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c(nH)c2c1cccc2)C(=O)O
InChI=1SC29H25N3O5c11676818(1316)3226(34)2324(27(32)35)29(28(36)373125(23)2010351222(20)33)14171530211142919(17)21h213152325303133H14H21H3(H3637)
MFCD06783176
ZINC000020548084
ZINC000245327399

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.