TPCN01235

Name Angustisepalin
Molecular Formula C22H24O8
Molecular Weight 416.43
CAS Registry Number 220146-17-8
SMILES CC1CCC2(O)C13CC(OC(=O)C3OC(=O)c1ccccc1)C1(O)C(=O)OCC12C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Illicium angustisepalum Aerial parts 0.001194% Phytochemistry 49(6): 1715-1717.(1998) 10.1016/s0031-9422(98)00299-4
Properties
HBA 8 HBD 2
HeavyAtoms 30 AlogP 0.98
TPSA 119.36 RotatableBonds 2
FractionCSP3 0.59 Rings 5
AromaticRings 1 AliphaticRings 4