TPCN04017

Name 2??,3??-O-diacetyl-3-O-??-L-arabinopyranosyl-23-hydroxyolea-12-en28-oic acid
Molecular Formula C39H60O10
Molecular Weight 688.90
CAS Registry Number 2363739-47-1
SMILES CC(=O)OC1C(O)COC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)O)CCC34C)C2(C)CO)C1OC(C)=O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Dipsacus asper Roots 0.000142% Phytochemistry, 2019, 162, 241-249. 10.1016/j.phytochem.2019.03.028
Properties
HBA 10 HBD 3
HeavyAtoms 49 AlogP 5.81
TPSA 148.82 RotatableBonds 6
FractionCSP3 0.87 Rings 6
AromaticRings 0 AliphaticRings 6