PCIDB

KNApSAcK Metabolite C00048382

Metabolite

KNApSAcK Entry

id C00048382
Name Epicandicandiol 18-palmitate
CAS RN 108335-53-1
Standard InChI InChI=1S/C36H62O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-33(38)39-27-34(3)22-18-23-35(4)30-21-20-29-26-36(30,25-28(29)2)32(37)24-31(34)35/h29-32,37H,2,5-27H2,1,3-4H3/t29?,30-,31+,32-,34+,35-,36-/m0/s1
Standard InChI (Main Layer) InChI=1S/C36H62O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-33(38)39-27-34(3)22-18-23-35(4)30-21-20-29-26-36(30,25-28(29)2)32(37)24-31(34)35/h29-32,37H,2,5-27H2,1,3-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2781

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Sideritis soluta 155263 Lamiaceae asterids Viridiplantae