PCIDB

KNApSAcK Metabolite C00048258

Metabolite

KNApSAcK Entry

id C00048258
Name 1-O-Acetylkhayanolide B
CAS RN 309946-47-2
Standard InChI InChI=1S/C29H36O11/c1-12(30)40-28-11-26(3)18(15(31)23(33)36-5)27(28,4)14-6-8-25(2)19-17(24(34)39-22(25)13-7-9-37-10-13)38-16(21(26)32)20(28)29(14,19)35/h7,9-10,14-22,31-32,35H,6,8,11H2,1-5H3/t14-,15+,16?,17+,18+,19?,20+,21-,22+,25-,26-,27-,28+,29-/m1/s1
Standard InChI (Main Layer) InChI=1S/C29H36O11/c1-12(30)40-28-11-26(3)18(15(31)23(33)36-5)27(28,4)14-6-8-25(2)19-17(24(34)39-22(25)13-7-9-37-10-13)38-16(21(26)32)20(28)29(14,19)35/h7,9-10,14-22,31-32,35H,6,8,11H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 255

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 2

Family

family name count
Meliaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Khaya ivorensis 486173 Meliaceae rosids Viridiplantae
Khaya senegalensis 587579 Meliaceae rosids Viridiplantae