TPCN05862

Name Cyclocarioside I
Molecular Formula C41H70O12
Molecular Weight 755.00
CAS Registry Number 172997-02-3
SMILES CC1OC(OC2CC3C4(C)CCC(OC5OC(CO)C(O)C5O)C(C)(C)C4CCC3(C)C3(C)CCC(C4(C)CCC(C(C)(C)O)O4)C23)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Juglandaceae Cyclocarya paliurus Leaves 0.000048% Bioorg Chem. 2020 Jan;95:103493. 10.1016/j.bioorg.2019.103493
Properties
HBA 12 HBD 7
HeavyAtoms 53 AlogP 3.03
TPSA 187.76 RotatableBonds 7
FractionCSP3 1.00 Rings 7
AromaticRings 0 AliphaticRings 7