Vitas-M small molecule compound
2-(4-methylphenyl)-2-oxoethyl 4-(1,3-dioxo-5-phenyloctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK290273
SMILES Cc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C(C1)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 C31H27NO5 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO5/c1-18-7-9-20(10-8-18)26(33)17-37-31(36)21-11-13-23(14-12-21)32-29(34)27-22-15-24(19-5-3-2-4-6-19)25(16-22)28(27)30(32)35/h2-14,22,24-25,27-28H,15-17H2,1H3InChIKey
XNBQWOMCCDWEHP-UHFFFAOYSA-NSynonyms
2(4methylphenyl)2oxoethyl4(13dioxo5phenyloctahydro2H47methanoisoindol2yl)benzoate
CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)C4C5CC(C4C3=O)C(C5)C6=CC=CC=C6
InChI=1SC31H27NO5c1187920(10818)26(33)173731(36)21111323(141221)3229(34)27221524(195324619)25(1622)28(27)30(32)35h2142224252728H1517H21H3
MFCD04041722
ZINC000101224290
ZINC000239433326
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