PCIDB

KNApSAcK Metabolite C00044788

Metabolite

KNApSAcK Entry

id C00044788
Name Grandifloroside 11-methyl ester / (+)-Grandifloroside 11-methyl ester
CAS RN 557790-50-8
Standard InChI InChI=1S/C27H34O12/c1-3-15-16(10-11-37-22(31)9-5-14-4-7-18(29)19(30)12-14)17(26(35)36-2)6-8-20(15)38-27-25(34)24(33)23(32)21(13-28)39-27/h3-7,9,12,15-16,20-21,23-25,27-30,32-34H,1,8,10-11,13H2,2H3/b9-5+/t15-,16+,20-,21-,23-,24+,25-,27-/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H34O12/c1-3-15-16(10-11-37-22(31)9-5-14-4-7-18(29)19(30)12-14)17(26(35)36-2)6-8-20(15)38-27-25(34)24(33)23(32)21(13-28)39-27/h3-7,9,12,15-16,20-21,23-25,27-30,32-34H,1,8,10-11,13H2,2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 374

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
Adina racemosa 170034 Rubiaceae asterids Viridiplantae