TPCN00230

Name Methyl 12-methoxychanofruticosinate;Methyl 12-methoxychanofruticos inate
Molecular Formula C24H28N2O6
Molecular Weight 440.50
CAS Registry Number 352276-74-5
SMILES COC(=O)N1c2c(OC)cccc2C23C4CN5CCCC(CCC12C(=O)OC)(CC4=O)C53
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Kopsia officinalis Aerial parts 0.001082% J Nat Prod, 2017, 80, 864-871. 10.1021/acs.jnatprod.6b00697
Apocynaceae Kopsia officinalis Stems 0.000620% Fitoterapia, 2020, 143, 104547. 10.1016/j.fitote.2020.104547
Properties
HBA 8 HBD 0
HeavyAtoms 32 AlogP 2.28
TPSA 85.38 RotatableBonds 2
FractionCSP3 0.63 Rings 6
AromaticRings 1 AliphaticRings 5