PCIDB

KNApSAcK Metabolite C00004458

Metabolite

KNApSAcK Entry

id C00004458
Name Selgin 7-O-glucoside
CAS RN 73413-70-4
Standard InChI InChI=1S/C22H22O12/c1-31-15-3-8(2-12(26)18(15)27)13-6-11(25)17-10(24)4-9(5-14(17)33-13)32-22-21(30)20(29)19(28)16(7-23)34-22/h2-6,16,19-24,26-30H,7H2,1H3/t16?,19-,20+,21?,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H22O12/c1-31-15-3-8(2-12(26)18(15)27)13-6-11(25)17-10(24)4-9(5-14(17)33-13)32-22-21(30)20(29)19(28)16(7-23)34-22/h2-6,16,19-24,26-30H,7H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 2

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 2

Family

family name count
Lamiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Stachys alopecuros (L.) Benth. 467599 Lamiaceae asterids Viridiplantae
Stachys scardica Griseb. 53171 Lamiaceae asterids Viridiplantae