TPCN03744

Name Caraganins A
Molecular Formula C36H54O10
Molecular Weight 646.82
CAS Registry Number 1477507-54-2
SMILES CC1(C(=O)O)CC(=O)C2(C)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Caragana microphylla Seeds 0.000860% J Nat Med 67, 190-195 (2013). 10.1007/s11418-011-0624-9
Properties
HBA 10 HBD 5
HeavyAtoms 46 AlogP 4.33
TPSA 170.82 RotatableBonds 4
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6