PCIDB

KNApSAcK Metabolite C00005831

Metabolite

KNApSAcK Entry

id C00005831
Name Hexandraside D
CAS RN 137218-02-1
Standard InChI InChI=1S/C39H50O19/c1-14(2)6-11-19-21(54-38-31(49)29(47)26(44)22(13-40)55-38)12-20(41)23-27(45)36(33(56-34(19)23)17-7-9-18(51-5)10-8-17)58-39-32(50)35(25(43)16(4)53-39)57-37-30(48)28(46)24(42)15(3)52-37/h6-10,12,15-16,22,24-26,28-32,35,37-44,46-50H,11,13H2,1-5H3/t15?,16?,22?,24-,25-,26+,28-,29-,30?,31?,32-,35?,37-,38+,39-/m0/s1
Standard InChI (Main Layer) InChI=1S/C39H50O19/c1-14(2)6-11-19-21(54-38-31(49)29(47)26(44)22(13-40)55-38)12-20(41)23-27(45)36(33(56-34(19)23)17-7-9-18(51-5)10-8-17)58-39-32(50)35(25(43)16(4)53-39)57-37-30(48)28(46)24(42)15(3)52-37/h6-10,12,15-16,22,24-26,28-32,35,37-44,46-50H,11,13H2,1-5H3

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 C072228

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Berberidaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Vancouveria hexandra 46959 Berberidaceae eudicotyledons Viridiplantae