TPCN00104

Name Plantagoguanidinic acid
Molecular Formula C11H19N3O2
Molecular Weight 225.29
CAS Registry Number 1174143-94-2
SMILES CC(C)=CCCC(C(=O)O)C1CN=C(N)N1
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Plantaginaceae Plantago depressa Seeds 0.004667% J Nat Prod, 2015, 78, 2822-2826. 10.1021/acs.jnatprod.5b00368
Properties
HBA 5 HBD 4
HeavyAtoms 16 AlogP 0.72
TPSA 87.71 RotatableBonds 5
FractionCSP3 0.64 Rings 1
AromaticRings 0 AliphaticRings 1