TPCN00723

Name Uncarialin D;Uncarialins D
Molecular Formula C22H26N2O5
Molecular Weight 398.46
CAS Registry Number 2557676-50-1
SMILES C=CC1CN2CCC3(OC2CC1C(=COC)C(=O)OC)C(=O)Nc1ccccc13
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Uncaria rhynchophylla Hooks 0.000036% J Nat Prod, 2019, 82, 3302-3310. 10.1021/acs.jnatprod.9b00532
Rubiaceae Uncaria rhynchophylla Stems 0.000036% Journal of Natural Products 83 10.1021/acs.jnatprod.9b00532
Properties
HBA 7 HBD 1
HeavyAtoms 29 AlogP 2.41
TPSA 77.10 RotatableBonds 4
FractionCSP3 0.45 Rings 4
AromaticRings 1 AliphaticRings 3