Vitas-M small molecule compound
1-oxo-2-(3,4,5-trimethoxybenzyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Catalog ID
STK685000
SMILES COc1cc(CN2CC34C(C2=O)C(C(O4)C=C3)C(=O)O)cc(c1OC)OC
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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 C19H21NO7 MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO7/c1-24-12-6-10(7-13(25-2)16(12)26-3)8-20-9-19-5-4-11(27-19)14(18(22)23)15(19)17(20)21/h4-7,11,14-15H,8-9H2,1-3H3,(H,22,23)InChIKey
DUBARIMOBPAYEK-UHFFFAOYSA-NSynonyms
1oxo2(345trimethoxybenzyl)123677ahexahydro3a6epoxyisoindole7carboxylicacid
COC1=CC(=CC(=C1OC)OC)CN2CC34C=CC(O3)C(C4C2=O)C(=O)O
InChI=1SC19H21NO7c12412610(713(252)16(12)263)8209195411(2719)14(18(22)23)15(19)17(20)21h47111415H89H213H3(H2223)
MFCD07369057
ZINC000002553857
ZINC000239297242
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