Vitas-M small molecule compound
methyl 4-(4,7-dimethyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)benzoate
Catalog ID
STL387156
SMILES COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)C
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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 C18H17NO5 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5/c1-17-8-9-18(2,24-17)13-12(17)14(20)19(15(13)21)11-6-4-10(5-7-11)16(22)23-3/h4-9,12-13H,1-3H3InChIKey
CGGHNGQHQKAQJH-UHFFFAOYSA-NSynonyms
CC12C=CC(O1)(C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OC)C
InChI=1SC18H17NO5c1178918(22417)1312(17)14(20)19(15(13)21)116410(5711)16(22)233h491213H13H3
methyl4(47dimethyl13dioxo133a477ahexahydro2H47epoxyisoindol2yl)benzoate
methyl4(47dimethyl13dioxo3a7adihydrooctahydro1H47epoxyisoindol2yl)benzoate
MFCD08726051
ZINC000100171800
ZINC000226627869
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