Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Catalog ID
STL521958
SMILES COc1cc2c(cc1OC)C/C(=C/c1ccc3c(c1)OCO3)/C2=O
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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 C19H16O5 MW 324.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16O5/c1-21-16-8-12-7-13(19(20)14(12)9-17(16)22-2)5-11-3-4-15-18(6-11)24-10-23-15/h3-6,8-9H,7,10H2,1-2H3/b13-5-InChIKey
PFUZNTHLZXFXIN-ACAGNQJTSA-NSynonyms
161464-06-8(2~(Z))2(13benzodioxol5ylmethylidene)56dimethoxy3~(H)inden1one
(2Z)2(13benzodioxol5ylmethylidene)56dimethoxy23dihydro1Hinden1one
(Z)2(BENZO(D)(13)DIOXOL5YLMETHYLENE)56DIMETHOXY23DIHYDRO1HINDEN1ONE
161464068
71754638
COc1cc2c(cc1OC)CC(=Cc1ccc3c(c1)OCO3)C2=O
InChI=1SC19H16O5c12116812713(19(20)14(12)917(16)222)511341518(611)24102315h3689H710H212H3b135
MFCD23136290
ZINC000085876008
ZINC85876008
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