Quercetin hydrate
CAS No.:
1001001-36-0
M. Wt:
-
M. Fa:
-
InChI Key:
OKXFBEYCJRMINR-UHFFFAOYSA-N
Names and Identifiers of 1001001-36-0
CAS Number |
1001001-36-0 |
|---|---|
EC Number |
684-881-2 |
IUPAC Name |
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one;hydrate |
InChI |
InChI=1S/C15H10O7.H2O/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6;/h1-5,16-19,21H;1H2 |
InChIKey |
OKXFBEYCJRMINR-UHFFFAOYSA-N |
Canonical SMILES |
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O.O |
