Compound Summary
Compound Information
quercetin
Compound Name: | quercetin |
Compound CID: | 5280343 |
Synonyms: | quercetin |
Iupac Name: | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one |
InChI: | InChI=1S/C15H10O7/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 |
InChIKey: | REFJWTPEDVJJIY-UHFFFAOYSA-N |
Canonical Smiles: | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O |
Isomeric Smiles: | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O |
Molecular Weight: | 302.23 |
Molecular Formula: | C15H10O7 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
quercetin
Molecular Weight: | 302.23 |
Molecular Formula: | C15H10O7 |
Hydrogen Bond Donor Count: | 5 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 22 |
Complexity: | 488 |
Synonyms
quercetin
Experimental Data
quercetin
Experimental Data Visualization
quercetin
Statistics Data
quercetin
Statistics Data Visualization
quercetin
