TPCN04322

Name 16??-Acetoxy-21??-hydroxy-22??-angeloyl-13??,28-oxydoolean-28??-ol 3-O-[??-rhamnopyranosyl-(1''''??6''')??-glucopyranosyl-(1''' ?? 4')] [??-glucopyranosyl-(1''?? 2')]??-arabinopyranoside
Molecular Formula C60H96O26
Molecular Weight 1233.40
CAS Registry Number 1460315-66-5
SMILES CC=C(C)C(=O)OC1C(O)C(C)(C)CC2C13C(O)OC21CCC2C4(C)CCC(OC5OCC(O)C(OC6OC(COC7OC(C)C(O)C(O)C7O)C(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC2(C)C1(C)CC3OC(C)=O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Primulaceae Maesa lanceolata Woods 0.001750% J Asian Nat Prod Res 14(11): 987-1001. 10.1080/10286020.2012.674302
Properties
HBA 26 HBD 13
HeavyAtoms 86 AlogP -1.34
TPSA 398.66 RotatableBonds 13
FractionCSP3 0.93 Rings 10
AromaticRings 0 AliphaticRings 10