PCIDB

KNApSAcK Metabolite C00001868

Metabolite

KNApSAcK Entry

id C00001868
Name Ipecoside
CAS RN 15401-60-2
Standard InChI InChI=1S/C27H35NO12/c1-4-14-16(8-18-15-9-20(32)19(31)7-13(15)5-6-28(18)12(2)30)17(25(36)37-3)11-38-26(14)40-27-24(35)23(34)22(33)21(10-29)39-27/h4,7,9,11,14,16,18,21-24,26-27,29,31-35H,1,5-6,8,10H2,2-3H3/t14-,16+,18-,21?,22-,23?,24?,26+,27+/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H35NO12/c1-4-14-16(8-18-15-9-20(32)19(31)7-13(15)5-6-28(18)12(2)30)17(25(36)37-3)11-38-26(14)40-27-24(35)23(34)22(33)21(10-29)39-27/h4,7,9,11,14,16,18,21-24,26-27,29,31-35H,1,5-6,8,10H2,2-3H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 1649

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09464

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Rubiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cephaelis acuminata 77880 Rubiaceae asterids Viridiplantae
Cephaelis ipecacuanha 77880 Rubiaceae asterids Viridiplantae