PCIDB

KNApSAcK Metabolite C00039817

Metabolite

KNApSAcK Entry

id C00039817
Name Myrtucommulone I / (+)-Myrtucommulone I
CAS RN 1051388-76-1
Standard InChI InChI=1S/C41H56O9/c1-14-15-16-17-22(42)26-29(43)24-21(18-19(2)3)25-32(44)37(6,7)35(46)39(10,11)34(25)49-30(24)27-23(20(4)5)28-33(45)38(8,9)36(47)40(12,13)41(28,48)50-31(26)27/h19-21,23,28,43,48H,14-18H2,1-13H3/t21-,23-,28-,41+/m1/s1
Standard InChI (Main Layer) InChI=1S/C41H56O9/c1-14-15-16-17-22(42)26-29(43)24-21(18-19(2)3)25-32(44)37(6,7)35(46)39(10,11)34(25)49-30(24)27-23(20(4)5)28-33(45)38(8,9)36(47)40(12,13)41(28,48)50-31(26)27/h19-21,23,28,43,48H,14-18H2,1-13H3

Cluster

Phytochemical cluster
KCF-S cluster No. 3925

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
Myrtaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Corymbia scabrida 368762 Myrtaceae rosids Viridiplantae