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

Structure

InChI Key LDXFCCZPPSEDCI-UHFFFAOYSA-N
Smiles CC1=CC=CC=C1[Sb](C1=CC=CC=C1C)C1=CC=CC=C1C
InChI
InChI=1S/3C7H7.Sb/c3*1-7-5-3-2-4-6-7;/h3*2-5H,1H3;

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H21Sb1
Molecular Weight 394.07
AlogP 5.0
Heavy Atoms 22.0

Cross References

Resources Reference
CAS NUMBER 23822-15-3
NORMAN SUSDAT