TPCN00556

Name 1??-(4??-hydroxybutyl)-plantagoguanidinic acid
Molecular Formula C15H27N3O3
Molecular Weight 297.40
CAS Registry Number 1820862-66-5
SMILES CC(C)=CCCC(C(=O)O)C1CN(CCCCO)C(N)=N1
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Plantaginaceae Plantago depressa Seeds 0.000140% J Nat Prod, 2015, 78, 2822-2826. 10.1021/acs.jnatprod.5b00368
Properties
HBA 6 HBD 4
HeavyAtoms 21 AlogP 1.21
TPSA 99.15 RotatableBonds 9
FractionCSP3 0.73 Rings 1
AromaticRings 0 AliphaticRings 1