Carmine
C22H20O13
Molecular FormulaC22H20O13
Molecular Weight492.4 g/mol
Exact Mass492.09039069
SMILESCC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=C(C(=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O
InChIKeyDGQLVPJVXFOQEV-NGOCYOHBSA-N
XLogP0.5
TPSA243 Ų
Complexity864
H-Bond Donors9
H-Bond Acceptors13
Rotatable Bonds3
Charge0
PubChem CID14749
Also Known As
Carmine1390-65-4B Rose liquid3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acidCarmine (Coccus cacti L.)Cochineal (Coccus cacti L.)Cochineal DyeDye, Cochineal3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-((2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)anthracene-2-carboxylic acidRefChem:574680DTXSID20442167-glucopyranosyl-3,5,6,8-tetrahydroxyl-1-methyl-9,10-dioxoanthracene-2-carboxylic acid215-724-4Carmine RedST0693397-[(5S,2R,3R,4R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)(2H-3,4,5,6-tetrahydropy ran-2-yl)]-3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic aci dNSC326224NCGC00091708-04SCHEMBL34094orb1218979