PCIDB

KNApSAcK Metabolite C00040765

Metabolite

KNApSAcK Entry

id C00040765
Name 12alpha-Acetoxyneotrichilenone / (+)-12alpha-Acetoxyneotrichilenone
CAS RN 220494-51-9
Standard InChI InChI=1S/C28H36O6/c1-15(29)34-23-13-20-26(4)9-7-21(31)25(2,3)19(26)12-22(32)28(20,6)24-18(30)11-17(27(23,24)5)16-8-10-33-14-16/h7-10,14,17,19-20,22-24,32H,11-13H2,1-6H3/t17-,19-,20+,22+,23-,24+,26-,27+,28-/m0/s1
Standard InChI (Main Layer) InChI=1S/C28H36O6/c1-15(29)34-23-13-20-26(4)9-7-21(31)25(2,3)19(26)12-22(32)28(20,6)24-18(30)11-17(27(23,24)5)16-8-10-33-14-16/h7-10,14,17,19-20,22-24,32H,11-13H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2073

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
Meliaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Turraea holstii 201020 Meliaceae rosids Viridiplantae