Vitas-M small molecule compound
5,6-bis(1,3-benzodioxol-5-yl)-2-(3-methylphenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Catalog ID
STK264394
SMILES Cc1cccc(c1)N1C(=O)C2C(C1=O)C1(C(=O)C2(c2ccccc2)C(=C1c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2)c1ccccc1
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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 C42H29NO7 MW 659.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H29NO7/c1-24-9-8-14-29(19-24)43-38(44)36-37(39(43)45)42(28-12-6-3-7-13-28)35(26-16-18-31-33(21-26)50-23-48-31)34(25-15-17-30-32(20-25)49-22-47-30)41(36,40(42)46)27-10-4-2-5-11-27/h2-21,36-37H,22-23H2,1H3InChIKey
LBHMIHHQIMMEAI-UHFFFAOYSA-NSynonyms
56bis(13benzodioxol5yl)2(3methylphenyl)47diphenyl3a477atetrahydro1H47methanoisoindole138(2H)trione
CC1=CC(=CC=C1)N2C(=O)C3C(C2=O)C4(C(=C(C3(C4=O)C5=CC=CC=C5)C6=CC7=C(C=C6)OCO7)C8=CC9=C(C=C8)OCO9)C1=CC=CC=C1
InChI=1SC42H29NO7c124981429(1924)4338(44)3637(39(43)45)42(28126371328)35(2616183133(2126)50234831)34(2515173032(2025)49224730)41(3640(42)46)27104251127h2213637H2223H21H3
MFCD01113550
ZINC000150355698
ZINC000150355704
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