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Chemistry

Mol. Mass

752.86

ALogP

11.35

Rule of 5

No

Rule of 3

No
Details
  • SMILES: O=C1C(=C(Oc2cc(OCc3ccccc3)cc(OCc4ccccc4)c12)c5ccc(OCc6ccccc6)c(OCc7ccccc7)c5)OCc8ccccc8
  • InChIKey: CSQNIJRRXIHHAY-UHFFFAOYSA-N
    InChI=1S/C50H40O7/c51-48-47-45(55-34-39-22-12-4-13-23-39)29-42(52-31-36-16-6-1-7-17-36)30-46(47)57-49(50(48)56-35-40-24-14-5-15-25-40)41-26-27-43(53-32-37-18-8-2-9-19-37)44(28-41)54-33-38-20-10-3-11-21-38/h1-30H,31-35H2
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2103922   ChEMBL
benzquercin

Quercetin   Wikipedia

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