Cyanidin
Representations & DB's id
| ||
| ChEBI: | CHEBI:27843 | |
|---|---|---|
| ChEMBL: | CHEMBL404515 | |
| PubChem: | 128861 | |
| IUPAC: | 2-(3,4-dihydroxyphenyl)chromenylium-3,5,7-triol | |
| Standard InChI: | InChI=1S/C15H10O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-6H,(H4-,16,17,18,19,20)/p+1 | |
| Standard InChI Key: | VEVZSMAEJFVWIL-UHFFFAOYSA-O | |
| SMILES: | Oc1cc(O)c2c(c1)[o+]c(c(c2)O)c1ccc(c(c1)O)O | |
Molecular propeties
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| AlogP: | 2.91 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 5 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 3 | |
| Molecular Weight: | 288.06 | |
| Topological polar surface area: | 102 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0 | |
| Number of carbons: | 15 | |