TPCN04724

Name Latifoloside C
Molecular Formula C53H86O22
Molecular Weight 1075.25
CAS Registry Number 194660-77-0
SMILES CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6C(O)C(C)(C)CCC6(C(=O)OC6OC(CO)C(O)C(O)C6O)CCC45C)C3(C)C)OCC(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Aquifoliaceae Ilex latifolia Barks 0.000340% Chem Pharm Bull (Tokyo) . 2001 Feb;49(2):239-41 10.1248/cpb.49.239
Amaryllidaceae Allium ascalonicum Subterraneous stems 0.000082% Nat Prod Res: 1-9. 10.1080/14786419.2020.1713122
Properties
HBA 22 HBD 13
HeavyAtoms 75 AlogP -1.40
TPSA 353.90 RotatableBonds 10
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9