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

Structure

InChI Key UGXZATJBUAYFHA-UHFFFAOYSA-N
Smiles C=1C=CC(=CC1)C(C)CC(C=2C=CC=CC2)CC(C=3C=CC=CC3)C
InChI
InChI=1/C25H28/c1-20(22-12-6-3-7-13-22)18-25(24-16-10-5-11-17-24)19-21(2)23-14-8-4-9-15-23/h3-17,20-21,25H,18-19H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H28
Molecular Weight 328.22
AlogP 7.16
Hydrogen Bond Acceptor 0.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 7.0
Polar Surface Area 0.0
Molecular species None
Aromatic Rings 3.0
Heavy Atoms 25.0

Cross References

Resources Reference
CAS NUMBER 17293-59-3
NORMAN SUSDAT
PubChem 23156726