PCIDB

KNApSAcK Metabolite C00001674

Metabolite

KNApSAcK Entry

id C00001674
Name Adifoline
CAS RN 20072-28-0
Standard InChI InChI=1S/C22H20N2O7/c1-9-18-12(14(21(28)30-2)8-31-22(18)29)6-15-19-13(7-16(23-15)20(26)27)11-5-10(25)3-4-17(11)24(9)19/h3-5,7-9,12,18,22,25,29H,6H2,1-2H3,(H,26,27)/t9-,12-,18-,22+/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H20N2O7/c1-9-18-12(14(21(28)30-2)8-31-22(18)29)6-15-19-13(7-16(23-15)20(26)27)11-5-10(25)3-4-17(11)24(9)19/h3-5,7-9,12,18,22,25,29H,6H2,1-2H3,(H,26,27)

Cluster

Phytochemical cluster
KCF-S cluster No. 8821

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09020

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Adina cordifolia 43493 Rubiaceae asterids Viridiplantae