PCIDB

KNApSAcK Metabolite C00050081

Metabolite

KNApSAcK Entry

id C00050081
Name E-6-O-p-coumaroyl scandoside methyl ester 10-O-methyl methyl ether
CAS RN 914955-43-4
Standard InChI InChI=1S/C27H32O13/c1-35-11-14-9-17(38-19(30)8-5-13-3-6-15(29)7-4-13)21-16(25(34)36-2)12-37-26(20(14)21)40-27-24(33)23(32)22(31)18(10-28)39-27/h3-9,12,17-18,20-24,26-29,31-33H,10-11H2,1-2H3/b8-5+/t17-,18-,20-,21+,22-,23+,24-,26+,27+/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H32O13/c1-35-11-14-9-17(38-19(30)8-5-13-3-6-15(29)7-4-13)21-16(25(34)36-2)12-37-26(20(14)21)40-27-24(33)23(32)22(31)18(10-28)39-27/h3-9,12,17-18,20-24,26-29,31-33H,10-11H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 213

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
Oldenlandia diffusa 254027 Rubiaceae asterids Viridiplantae