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Chemistry

Mol. Mass

518.5544

ALogP

6.38

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC(C)C1=C(O)C(O)=C(C=O)C2=C(O)C(=C(C)C=C12)C3=C(O)C4=C(C=C3C)C(C(C)C)=C(O)C(O)=C4C=O
  • InChIKey: QBKSWRVVCFFDOT-UHFFFAOYSA-N
    1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL51483   ChEMBL
gossypol

8DY2X8LXW4   NCATS
gossypol, (r)- *

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