PCIDB

KNApSAcK Metabolite C00014096

Metabolite

KNApSAcK Entry

id C00014096
Name Isoswertisin 6'''-O-feruloyl 2''-O-glucoside
CAS RN 319480-85-8
Standard InChI InChI=1S/C38H40O18/c1-50-23-11-16(3-9-19(23)41)4-10-27(44)52-15-26-31(46)32(47)34(49)38(55-26)56-37-33(48)30(45)25(14-39)54-36(37)29-24(51-2)13-21(43)28-20(42)12-22(53-35(28)29)17-5-7-18(40)8-6-17/h3-13,25-26,30-34,36-41,43,45-49H,14-15H2,1-2H3/b10-4+/t25?,26?,30-,31-,32+,33+,34?,36+,37?,38+/m1/s1
Standard InChI (Main Layer) InChI=1S/C38H40O18/c1-50-23-11-16(3-9-19(23)41)4-10-27(44)52-15-26-31(46)32(47)34(49)38(55-26)56-37-33(48)30(45)25(14-39)54-36(37)29-24(51-2)13-21(43)28-20(42)12-22(53-35(28)29)17-5-7-18(40)8-6-17/h3-13,25-26,30-34,36-41,43,45-49H,14-15H2,1-2H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 7

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Rhamnaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ziziphus jujuba 326968 Rhamnaceae rosids Viridiplantae