PCIDB

KNApSAcK Metabolite C00049771

Metabolite

KNApSAcK Entry

id C00049771
Name 16,23,24-Triketomelianin B / (-)-16,23,24-Triketomelianin B
CAS RN 201788-71-8
Standard InChI InChI=1S/C41H52O10/c1-22(42)49-32-19-29-37(3,4)31(51-36(47)24-13-11-10-12-14-24)20-33(50-23(2)43)40(29,8)28-15-16-39(7)30(41(28,32)9)18-26(44)34(39)25-17-27(45)35(46)38(5,6)48-21-25/h10-14,18,25,28-29,31-34H,15-17,19-21H2,1-9H3/t25-,28-,29+,31-,32-,33+,34-,39-,40-,41-/m1/s1
Standard InChI (Main Layer) InChI=1S/C41H52O10/c1-22(42)49-32-19-29-37(3,4)31(51-36(47)24-13-11-10-12-14-24)20-33(50-23(2)43)40(29,8)28-15-16-39(7)30(41(28,32)9)18-26(44)34(39)25-17-27(45)35(46)38(5,6)48-21-25/h10-14,18,25,28-29,31-34H,15-17,19-21H2,1-9H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2887

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL412738

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
Melia volkensii 643111 Meliaceae rosids Viridiplantae