PCIDB

KNApSAcK Metabolite C00028128

Metabolite

KNApSAcK Entry

id C00028128
Name Daechuine S3
CAS RN 123089-20-3
Standard InChI InChI=1S/C34H53N5O6/c1-10-20(4)27-31(40)35-17-15-23-19-24(13-14-25(23)44-9)45-26-16-18-39(30(26)33(42)36-27)34(43)28(21(5)11-2)37-32(41)29(38(7)8)22(6)12-3/h13-15,17,19-22,26-30H,10-12,16,18H2,1-9H3,(H,35,40)(H,36,42)(H,37,41)/b17-15+/t20-,21-,22?,26+,27?,28+,29+,30+/m1/s1
Standard InChI (Main Layer) InChI=1S/C34H53N5O6/c1-10-20(4)27-31(40)35-17-15-23-19-24(13-14-25(23)44-9)45-26-16-18-39(30(26)33(42)36-27)34(43)28(21(5)11-2)37-32(41)29(38(7)8)22(6)12-3/h13-15,17,19-22,26-30H,10-12,16,18H2,1-9H3,(H,35,40)(H,36,42)(H,37,41)

Cluster

Phytochemical cluster
KCF-S cluster No. 150

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
Rhamnaceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Paliurus ramossisimus 106692 Rhamnaceae rosids Viridiplantae
Zizyphus jujuba var.inermis