TPCN04700

Name Alisol W
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number 2410372-09-5
SMILES CC(CC1OC(C)(C)C1O)C1=C2CC(O)C3C4(C)CCC(=O)C(C)(C)C4CCC3(C)C2(C)CC1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Alismataceae Anemone taipaiensis Subterraneous stems 0.000100% Nat Prod Res 33(21): 3083-3088. 10.1080/10286020.2015.1043903
Properties
HBA 4 HBD 2
HeavyAtoms 34 AlogP 5.84
TPSA 66.76 RotatableBonds 3
FractionCSP3 0.90 Rings 5
AromaticRings 0 AliphaticRings 5