Vitas-M small molecule compound
(2Z)-2-(3,4-dihydroxybenzylidene)-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Catalog ID
STL522062
SMILES COc1cc2c(cc1OC)C/C(=C/c1ccc(c(c1)O)O)/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 C18H16O5 MW 312.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O5/c1-22-16-8-11-7-12(18(21)13(11)9-17(16)23-2)5-10-3-4-14(19)15(20)6-10/h3-6,8-9,19-20H,7H2,1-2H3/b12-5-InChIKey
MYIRKKOWEWWNJD-XGICHPGQSA-NSynonyms
1436015-77-8(2~(Z))2((34dihydroxyphenyl)methylidene)56dimethoxy3~(H)inden1one
(2Z)2(34dihydroxybenzylidene)56dimethoxy23dihydro1Hinden1one
(Z)2(34DIHYDROXYBENZYLIDENE)56DIMETHOXY23DIHYDRO1HINDEN1ONE
1436015778
71754662
COc1cc2c(cc1OC)CC(=Cc1ccc(c(c1)O)O)C2=O
InChI=1SC18H16O5c12216811712(18(21)13(11)917(16)232)5103414(19)15(20)610h36891920H7H212H3b125
MFCD23136309
ZINC000085876143
ZINC85876143
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