Vitas-M small molecule compound
2-(5-acetyl-2-methoxyphenyl)-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STK727597
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C1(OC2C=C1)CO)C(=O)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 C18H17NO6 MW 343.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO6/c1-9(21)10-3-4-12(24-2)11(7-10)19-16(22)14-13-5-6-18(8-20,25-13)15(14)17(19)23/h3-7,13-15,20H,8H2,1-2H3InChIKey
BPDYHHRWWLUABH-UHFFFAOYSA-NSynonyms
2(5acetyl2methoxyphenyl)4(hydroxymethyl)3a477atetrahydro1H47epoxyisoindole13(2H)dione
2(5acetyl2methoxyphenyl)7(hydroxymethyl)47adihydro3aHoctahydro1H47epoxyisoindole13dione
CC(=O)C1=CC(=C(C=C1)OC)N2C(=O)C3C4C=CC(C3C2=O)(O4)CO
InChI=1SC18H17NO6c19(21)103412(242)11(710)1916(22)14135618(8202513)15(14)17(19)23h37131520H8H212H3
MFCD01802293
ZINC000101359635
ZINC000101359642
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