PCIDB

KNApSAcK Metabolite C00008690

Metabolite

KNApSAcK Entry

id C00008690
Name 2''-Acetylcallunin
CAS RN 164920-58-5
Standard InChI InChI=1S/C23H24O13/c1-8(25)33-22-17(31)15(29)13(7-24)34-23(22)36-20-12(28)6-11(27)14-16(30)18(32)19(35-21(14)20)9-2-4-10(26)5-3-9/h2-6,13,15,17-19,22-24,26-29,31-32H,7H2,1H3/t13?,15-,17+,18+,19-,22?,23+/m1/s1
Standard InChI (Main Layer) InChI=1S/C23H24O13/c1-8(25)33-22-17(31)15(29)13(7-24)34-23(22)36-20-12(28)6-11(27)14-16(30)18(32)19(35-21(14)20)9-2-4-10(26)5-3-9/h2-6,13,15,17-19,22-24,26-29,31-32H,7H2,1H3

Cluster

Phytochemical cluster No. 14
KCF-S cluster No. 12

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
Calluna vulgaris 13385 Ericaceae asterids Viridiplantae