PCIDB

KNApSAcK Metabolite C00044754

Metabolite

KNApSAcK Entry

id C00044754
Name Excoecarin R1
CAS RN 479665-78-6
Standard InChI InChI=1S/C40H64O11/c1-12-35(6)17-13-26-37(8,22-30(44)45)25(15-18-38(26,9)50-35)34(4,5)32(48)49-23-28(41)40(11)20-16-27-36(7,21-29(42)43)24(33(2,3)31(46)47)14-19-39(27,10)51-40/h12,24-28,41H,1,13-23H2,2-11H3,(H,42,43)(H,44,45)(H,46,47)/t24-,25-,26+,27+,28-,35?,36-,37-,38+,39+,40-/m1/s1
Standard InChI (Main Layer) InChI=1S/C40H64O11/c1-12-35(6)17-13-26-37(8,22-30(44)45)25(15-18-38(26,9)50-35)34(4,5)32(48)49-23-28(41)40(11)20-16-27-36(7,21-29(42)43)24(33(2,3)31(46)47)14-19-39(27,10)51-40/h12,24-28,41H,1,13-23H2,2-11H3,(H,42,43)(H,44,45)(H,46,47)

Cluster

Phytochemical cluster
KCF-S cluster No. 4436

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
Euphorbiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Excoecaria agallocha 241838 Euphorbiaceae rosids Viridiplantae