TPCN00515

Name Hydroxyvincosamide
Molecular Formula C26H32N2O10
Molecular Weight 532.55
CAS Registry Number 2588412-45-5
SMILES O=C1C2=COC(OC3OC(CO)C(O)C(O)C3O)C(C(O)CO)C2CC2c3[nH]c4ccccc4c3CCN12
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Uncaria rhynchophylla Stems 0.000177% J Nat Prod, 2019, 82, 3288-3301. 10.1021/acs.jnatprod.9b00490
Properties
HBA 12 HBD 7
HeavyAtoms 38 AlogP -1.36
TPSA 185.17 RotatableBonds 5
FractionCSP3 0.58 Rings 6
AromaticRings 2 AliphaticRings 4