PCIDB

KNApSAcK Metabolite C00021223

Metabolite

KNApSAcK Entry

id C00021223
Name (3beta)-28-Norlup-20(29)-ene-3,17-diol 3-acetate
CAS RN 202651-67-0
Standard InChI InChI=1S/C31H50O3/c1-19(2)21-11-16-31(33)18-17-29(7)22(26(21)31)9-10-24-28(6)14-13-25(34-20(3)32)27(4,5)23(28)12-15-30(24,29)8/h21-26,33H,1,9-18H2,2-8H3/t21-,22+,23-,24+,25-,26+,28-,29+,30+,31-/m0/s1
Standard InChI (Main Layer) InChI=1S/C31H50O3/c1-19(2)21-11-16-31(33)18-17-29(7)22(26(21)31)9-10-24-28(6)14-13-25(34-20(3)32)27(4,5)23(28)12-15-30(24,29)8/h21-26,33H,1,9-18H2,2-8H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 23

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
Melaleuca leucadendron 164925 Myrtaceae rosids Viridiplantae