Vitas-M small molecule compound
(2E)-3-(6,7-dimethoxy-1,3-benzodioxol-5-yl)prop-2-enoic acid
Catalog ID
STK693812
SMILES COc1c(/C=C/C(=O)O)cc2c(c1OC)OCO2
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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 C12H12O6 MW 252.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12O6/c1-15-10-7(3-4-9(13)14)5-8-11(12(10)16-2)18-6-17-8/h3-5H,6H2,1-2H3,(H,13,14)/b4-3+InChIKey
NLWULWMJACYONC-ONEGZZNKSA-NSynonyms
32529-15-0(2E)3(67DIMETHOXY(2HBENZO(D)13DIOXOLEN5YL))PROP2ENOICACID
(2E)3(67dimethoxy13benzodioxol5yl)prop2enoicacid
(E)3(67dimethoxy13benzodioxol5yl)prop2enoicacid
3(67DIMETHOXY2H13BENZODIOXOL5YL)PROP2ENOICACID
32529150
COC1=C(C2=C(C=C1C=CC(=O)O)OCO2)OC
COc1c(C=CC(=O)O)cc2c(c1OC)OCO2
InChI=1SC12H12O6c115107(349(13)14)5811(12(10)162)186178h35H6H212H3(H1314)b43+
MFCD09261486
ZINC000014987623
ZINC14987623
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