PCIDB

KNApSAcK Metabolite C00035517

Metabolite

KNApSAcK Entry

id C00035517
Name Adenolin B
CAS RN 146436-17-1
Standard InChI InChI=1S/C22H30O8/c1-10-12-6-13(24)15-20-9-30-22(28,21(15,7-12)17(10)26)18(27)16(20)19(3,5-4-14(20)25)8-29-11(2)23/h12-16,18,24-25,27-28H,1,4-9H2,2-3H3/t12?,13-,14+,15+,16-,18+,19+,20+,21+,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H30O8/c1-10-12-6-13(24)15-20-9-30-22(28,21(15,7-12)17(10)26)18(27)16(20)19(3,5-4-14(20)25)8-29-11(2)23/h12-16,18,24-25,27-28H,1,4-9H2,2-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 83

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
Isodon oresbius 204130 Lamiaceae asterids Viridiplantae
Isodon sinuolata 204130 Lamiaceae asterids Viridiplantae