PCIDB

KNApSAcK Metabolite C00006324

Metabolite

KNApSAcK Entry

id C00006324
Name Swertiajaponin 3'-O-gentiobioside
CAS RN 76166-51-3
Standard InChI InChI=1S/C34H42O21/c1-49-15-6-16-20(25(42)21(15)32-29(46)26(43)22(39)17(7-35)52-32)12(38)5-13(51-16)10-2-3-11(37)14(4-10)53-34-31(48)28(45)24(41)19(55-34)9-50-33-30(47)27(44)23(40)18(8-36)54-33/h2-6,17-19,22-24,26-37,39-48H,7-9H2,1H3/t17?,18?,19?,22-,23-,24-,26+,27+,28+,29?,30?,31?,32+,33-,34-/m1/s1
Standard InChI (Main Layer) InChI=1S/C34H42O21/c1-49-15-6-16-20(25(42)21(15)32-29(46)26(43)22(39)17(7-35)52-32)12(38)5-13(51-16)10-2-3-11(37)14(4-10)53-34-31(48)28(45)24(41)19(55-34)9-50-33-30(47)27(44)23(40)18(8-36)54-33/h2-6,17-19,22-24,26-37,39-48H,7-9H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 5

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Poaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Phragmites australis 29695 Poaceae Liliopsida Viridiplantae