PCIDB

KNApSAcK Metabolite C00048173

Metabolite

KNApSAcK Entry

id C00048173
Name Swietenitin K / (+)-Swietenitin K
CAS RN 1173892-13-1
Standard InChI InChI=1S/C43H56O18/c1-13-22(3)31(49)55-32-34(6)21-39(56-24(5)45)36(8,26(34)17-28(47)50-10)42-27(46)18-35(7,30(54-23(4)44)25-15-16-53-20-25)38(19-29(48)51-11)43(42,60-37(9,58-38)59-42)33-41(32,39)61-40(14-2,52-12)57-33/h13,15-16,20,26-27,30,32-33,46H,14,17-19,21H2,1-12H3/b22-13+/t26-,27+,30-,32-,33?,34+,35-,36?,37+,38-,39+,40+,41-,42-,43-/m0/s1
Standard InChI (Main Layer) InChI=1S/C43H56O18/c1-13-22(3)31(49)55-32-34(6)21-39(56-24(5)45)36(8,26(34)17-28(47)50-10)42-27(46)18-35(7,30(54-23(4)44)25-15-16-53-20-25)38(19-29(48)51-11)43(42,60-37(9,58-38)59-42)33-41(32,39)61-40(14-2,52-12)57-33/h13,15-16,20,26-27,30,32-33,46H,14,17-19,21H2,1-12H3

Cluster

Phytochemical cluster
KCF-S cluster No. 196

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
Swietenia macrophylla 43891 Meliaceae rosids Viridiplantae