Vitas-M small molecule compound
6-(3,4-dihydroxyphenyl)-4,8-diethoxy-1,3-dimethylcyclohepta[c]furanium
Catalog ID
STL059314
SMILES CCOc1cc(cc(c2c1c(C)[o+]c2C)OCC)c1ccc(c(c1)O)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 C21H23O5 MW 355.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22O5/c1-5-24-18-10-15(14-7-8-16(22)17(23)9-14)11-19(25-6-2)21-13(4)26-12(3)20(18)21/h7-11H,5-6H2,1-4H3,(H-,22,23)/p+1InChIKey
VRLWURINOVJHOL-UHFFFAOYSA-OSynonyms
(6(34DIHYDROXYPHENYL)4ETHOXY13DIMETHYLCYCLOHEPTA(C)FURAN8YLIDENE)ETHYLOXIDANIUM
(O)(Cl)(=O)(=O)=OCCOc1cc(cc(c2c1c(C)(o+)c2C)OCC)c1ccc(c(c1)O)O
13DIMETHYL48DIETHOXY6(34DIHYDROXYPHENYL)6HCYCLOHEPTA(C)FURAN6YLIUM
6(34dihydroxyphenyl)48diethoxy13dimethylcyclohepta(c)furan2iumperchlorate
6(34dihydroxyphenyl)48diethoxy13dimethylcyclohepta(c)furanium
CCOC1=CC(=CC(=(O+)CC)C2=C(OC(=C12)C)C)C3=CC(=C(C=C3)O)O
CCOc1cc(cc(c2c1c(C)(o+)c2C)OCC)c1ccc(c(c1)O)O
InChI=1SC21H22O5c1524181015(147816(22)17(23)914)1119(2562)2113(4)2612(3)20(18)21h711H56H214H3(H2223)p+1
ZINC04856622
ZINC4856622
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