TPCN00585

Name 12-methoxychanofruticosinic acid
Molecular Formula C23H26N2O6
Molecular Weight 426.47
CAS Registry Number 2088730-22-5
SMILES COC(=O)N1c2c(OC)cccc2C23C4CN5CCCC(CCC12C(=O)O)(CC4=O)C53
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Kopsia officinalis Aerial parts 0.000118% J Nat Prod, 2017, 80, 864-871. 10.1021/acs.jnatprod.6b00697
Properties
HBA 8 HBD 1
HeavyAtoms 31 AlogP 2.19
TPSA 96.38 RotatableBonds 2
FractionCSP3 0.61 Rings 6
AromaticRings 1 AliphaticRings 5