PCIDB

KNApSAcK Metabolite C00045828

Metabolite

KNApSAcK Entry

id C00045828
Name Daucosterol 6'-linoleate
CAS RN 79380-30-6
Standard InChI InChI=1S/C53H90O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-47(54)58-36-46-48(55)49(56)50(57)51(60-46)59-41-31-33-52(6)40(35-41)27-28-42-44-30-29-43(53(44,7)34-32-45(42)52)38(5)25-26-39(9-2)37(3)4/h13-14,16-17,27,37-39,41-46,48-51,55-57H,8-12,15,18-26,28-36H2,1-7H3/b14-13-,17-16-/t38-,39-,41+,42+,43-,44+,45+,46-,48?,49+,50-,51-,52+,53-/m1/s1
Standard InChI (Main Layer) InChI=1S/C53H90O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-47(54)58-36-46-48(55)49(56)50(57)51(60-46)59-41-31-33-52(6)40(35-41)27-28-42-44-30-29-43(53(44,7)34-32-45(42)52)38(5)25-26-39(9-2)37(3)4/h13-14,16-17,27,37-39,41-46,48-51,55-57H,8-12,15,18-26,28-36H2,1-7H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1152

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL503276

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Ranunculaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cimicifuga racemosa 64040 Ranunculaceae eudicotyledons Viridiplantae