TPCN01484

Name 3??-Hydroxy-8??-epoxymethylacriloiloxy-4(15),10(14),11 (13)-trienguaian-6,12-olide
Molecular Formula C19H22O6
Molecular Weight 346.38
CAS Registry Number 152378-26-2
SMILES C=C1CC(OC(=O)C2(C)CO2)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Saussurea calcicola Aerial parts 0.000400% Arch Pharm Res 28(10): 1142-1146.(2005) 10.1007/bf02972976
Properties
HBA 6 HBD 1
HeavyAtoms 25 AlogP 1.30
TPSA 85.36 RotatableBonds 2
FractionCSP3 0.58 Rings 4
AromaticRings 0 AliphaticRings 4