Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key OVYNMPKAJJJORA-UHFFFAOYSA-N
Smiles C1=CC=C2C(=C1)C1=CC3=CC=CC=C3C3=C4C=CC=CC4=CC2=C13
InChI
InChI=1S/C24H14/c1-3-9-17-15(7-1)13-21-19-11-5-6-12-20(19)22-14-16-8-2-4-10-18(16)23(17)24(21)22/h1-14H

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H14
Molecular Weight 302.11
AlogP 6.79
Heavy Atoms 24.0

Cross References

Resources Reference
CAS NUMBER 2997-45-7
NORMAN SUSDAT