TPCN02748

Name 7R-Hydroxy-14-deoxyandrographolide
Molecular Formula C20H30O5
Molecular Weight 350.46
CAS Registry Number 1020408-22-3
SMILES C=C1C(O)CC2C(C)(CO)C(O)CCC2(C)C1CCC1=CCOC1=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Acanthaceae Andrographis paniculata Aerial parts 0.000310% J Nat Prod 71, 852-855 (2008). 10.1021/np0704452
Properties
HBA 5 HBD 3
HeavyAtoms 25 AlogP 1.96
TPSA 86.99 RotatableBonds 4
FractionCSP3 0.75 Rings 3
AromaticRings 0 AliphaticRings 3