PCIDB

KNApSAcK Metabolite C00020040

Metabolite

KNApSAcK Entry

id C00020040
Name Esculetin 6-O-brta-D-[6'(3-hydroxy-3-methylglutaryl)]glucoside
CAS RN 132923-05-8
Standard InChI InChI=1S/C21H24O13/c1-21(30,6-14(23)24)7-16(26)31-8-13-17(27)18(28)19(29)20(34-13)33-12-4-9-2-3-15(25)32-11(9)5-10(12)22/h2-5,13,17-20,22,27-30H,6-8H2,1H3,(H,23,24)/t13?,17-,18+,19?,20-,21?/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H24O13/c1-21(30,6-14(23)24)7-16(26)31-8-13-17(27)18(28)19(29)20(34-13)33-12-4-9-2-3-15(25)32-11(9)5-10(12)22/h2-5,13,17-20,22,27-30H,6-8H2,1H3,(H,23,24)

Cluster

Phytochemical cluster
KCF-S cluster No. 3443

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
Ericaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ledum palustre 49170 Ericaceae asterids Viridiplantae