PCIDB

KNApSAcK Metabolite C00019921

Metabolite

KNApSAcK Entry

id C00019921
Name (-)-2'beta-{(E)-3-Hydroxy-3-methylbut-1-enyl}-2'-deoxybruceol
CAS RN 160663-83-2
Standard InChI InChI=1S/C24H28O5/c1-22(2,26)10-8-15-19-14-9-11-24(15,5)29-21-13-6-7-18(25)27-16(13)12-17(20(19)21)28-23(14,3)4/h6-8,10,12,14-15,19,26H,9,11H2,1-5H3/b10-8+/t14?,15-,19?,24+/m1/s1
Standard InChI (Main Layer) InChI=1S/C24H28O5/c1-22(2,26)10-8-15-19-14-9-11-24(15,5)29-21-13-6-7-18(25)27-16(13)12-17(20(19)21)28-23(14,3)4/h6-8,10,12,14-15,19,26H,9,11H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2712

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Rutaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Eriostemon myoporoides 68542 Rutaceae rosids Viridiplantae