TPCN04048

Name 16alpha-acetoxy-21beta,22alpha-O-diangeloyloxy-23,28-dihydroxyolean-12-ene 3beta-O-beta-D-xylopyranosyl-(1 --> 3)-alpha-L-arabinopyranosyl-(1 --> 3)-beta-D-glucuronopyranoside
Molecular Formula C58H88O23
Molecular Weight 1153.32
CAS Registry Number 1885127-03-6
SMILES CC=C(C)C(=O)OC1C(OC(=O)C(C)=CC)C2(CO)C(OC(C)=O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(OC8OCC(O)C(O)C8O)C7O)C6O)C(C)(CO)C5CCC43C)C2CC1(C)C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Theaceae Camellia oleifera Roots 0.000109% J Asian Nat Prod Res, 2015, 17, 800-807. 10.1080/10286020.2015.1004630
Properties
HBA 23 HBD 10
HeavyAtoms 81 AlogP 1.47
TPSA 353.65 RotatableBonds 14
FractionCSP3 0.83 Rings 8
AromaticRings 0 AliphaticRings 8