TPCN05022

Name Compound 3
Molecular Formula C41H66O15
Molecular Weight 798.96
CAS Registry Number 351405-71-5
SMILES CC1C2C3=CCC4C5(C)CC(O)C(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C(=O)OC2OC(CO)C(O)C(O)C2O)CCC1(C)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Tupidanthus calyptratus Aerial parts 0.001286% J Nat Prod 64, 750-753 (2001) 10.1021/np000375y
Properties
HBA 15 HBD 10
HeavyAtoms 56 AlogP -0.13
TPSA 256.29 RotatableBonds 6
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7