PCIDB

KNApSAcK Metabolite C00032392

Metabolite

KNApSAcK Entry

id C00032392
Name Tricalysioside E / (-)-Tricalysioside E
CAS RN 438632-47-4
Standard InChI InChI=1S/C32H48O14/c1-30-6-5-17-15(8-21(35)43-17)16(30)4-7-31-9-14(2-3-20(30)31)32(12-31,13-34)46-29-27(41)25(39)23(37)19(45-29)11-42-28-26(40)24(38)22(36)18(10-33)44-28/h8,14,16-20,22-29,33-34,36-41H,2-7,9-13H2,1H3/t14-,16-,17-,18-,19-,20+,22-,23-,24+,25+,26-,27-,28?,29+,30-,31+,32+/m1/s1
Standard InChI (Main Layer) InChI=1S/C32H48O14/c1-30-6-5-17-15(8-21(35)43-17)16(30)4-7-31-9-14(2-3-20(30)31)32(12-31,13-34)46-29-27(41)25(39)23(37)19(45-29)11-42-28-26(40)24(38)22(36)18(10-33)44-28/h8,14,16-20,22-29,33-34,36-41H,2-7,9-13H2,1H3

Cluster

Phytochemical cluster
KCF-S cluster No. 791

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

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
Tricalysia dubia OHWI 58438 Rubiaceae asterids Viridiplantae