PCIDB

KNApSAcK Metabolite C00029848

Metabolite

KNApSAcK Entry

id C00029848
Name Brandioside
CAS RN 133393-81-4
Standard InChI InChI=1S/C37H48O20/c1-15-26(44)29(47)28(46)24(52-15)14-51-37-34(55-25(43)9-6-18-4-7-20(39)22(41)12-18)32(56-35-31(49)30(48)27(45)16(2)53-35)33(54-17(3)38)36(57-37)50-11-10-19-5-8-21(40)23(42)13-19/h4-9,12-13,15-16,24,26-37,39-42,44-49H,10-11,14H2,1-3H3/b9-6+
Standard InChI (Main Layer) InChI=1S/C37H48O20/c1-15-26(44)29(47)28(46)24(52-15)14-51-37-34(55-25(43)9-6-18-4-7-20(39)22(41)12-18)32(56-35-31(49)30(48)27(45)16(2)53-35)33(54-17(3)38)36(57-37)50-11-10-19-5-8-21(40)23(42)13-19/h4-9,12-13,15-16,24,26-37,39-42,44-49H,10-11,14H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 33

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN C070029

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Callicarpa japonica Thunb.var.luxurians Rehd. 21922 Lamiaceae asterids Viridiplantae