Vitas-M small molecule compound
methyl 2-chloro-5-[4-(hydroxymethyl)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl]benzoate
Catalog ID
STL388178
SMILES COC(=O)c1cc(ccc1Cl)N1C(=O)C2C(C1=O)C1(OC2C=C1)CO
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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 C17H14ClNO6 MW 363.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClNO6/c1-24-16(23)9-6-8(2-3-10(9)18)19-14(21)12-11-4-5-17(7-20,25-11)13(12)15(19)22/h2-6,11-13,20H,7H2,1H3InChIKey
MYMVUHVMVHOLJG-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=CC(=C1)N2C(=O)C3C4C=CC(C3C2=O)(O4)CO)Cl
InChI=1SC17H14ClNO6c12416(23)968(2310(9)18)1914(21)12114517(7202511)13(12)15(19)22h26111320H7H21H3
methyl2chloro5(4(hydroxymethyl)13dioxo133a477ahexahydro2H47epoxyisoindol2yl)benzoate
methyl2chloro5(7(hydroxymethyl)13dioxo47adihydro3aHoctahydro1H47epoxyisoindol2yl)benzoate
MFCD02633682
ZINC000101361094
ZINC000101361102
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