Vitas-M small molecule compound
2-(2,5-dimethylphenyl)-2-oxoethyl 2,6-bis(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Catalog ID
STK376667
SMILES O=C(C(N1C(=O)C2C(C1=O)C1CC2C=C1)CCCCN1C(=O)C2C(C1=O)C1CC2C=C1)OCC(=O)c1cc(C)ccc1C
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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 C34H36N2O7 MW 584.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N2O7/c1-17-6-7-18(2)23(13-17)25(37)16-43-34(42)24(36-32(40)28-21-10-11-22(15-21)29(28)33(36)41)5-3-4-12-35-30(38)26-19-8-9-20(14-19)27(26)31(35)39/h6-11,13,19-22,24,26-29H,3-5,12,14-16H2,1-2H3InChIKey
UXLKJXVIKDYIOP-UHFFFAOYSA-NSynonyms
2(25dimethylphenyl)2oxoethyl26bis(13dioxo133a477ahexahydro2H47methanoisoindol2yl)hexanoate
CC1=CC(=C(C=C1)C)C(=O)COC(=O)C(CCCCN2C(=O)C3C4CC(C3C2=O)C=C4)N5C(=O)C6C7CC(C6C5=O)C=C7
InChI=1SC34H36N2O7c1176718(2)23(1317)25(37)164334(42)24(3632(40)2821101122(1521)29(28)33(36)41)534123530(38)26198920(1419)27(26)31(35)39h611131922242629H35121416H212H3
MFCD01362246
ZINC000102127416
ZINC000245328552
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