TPCN01382

Name Chlorohyssopifolin A
Molecular Formula C19H24Cl2O7
Molecular Weight 435.30
CAS Registry Number 37006-36-3
SMILES C=C1CC(OC(=O)C(C)(O)CCl)C2C(=C)C(=O)OC2C2C1CC(O)C2(O)CCl
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Saussurea alata Whole plants 0.000600% Nat Prod Res 21(3): 221-226.(2007) 10.1080/14786410601130752
Properties
HBA 7 HBD 3
HeavyAtoms 28 AlogP 0.91
TPSA 113.29 RotatableBonds 4
FractionCSP3 0.68 Rings 3
AromaticRings 0 AliphaticRings 3