PCIDB

KNApSAcK Metabolite C00047579

Metabolite

KNApSAcK Entry

id C00047579
Name Sootepin C / (+)-Sootepin C
CAS RN 1154518-95-2
Standard InChI InChI=1S/C31H50O3/c1-21(2)9-8-10-22(3)24-13-15-29(6)26-12-11-25(23(4)19-32)30(16-14-27(33)34-7)20-31(26,30)18-17-28(24,29)5/h9,22,24-26,32H,4,8,10-20H2,1-3,5-7H3/t22-,24-,25+,26+,28-,29+,30-,31+/m1/s1
Standard InChI (Main Layer) InChI=1S/C31H50O3/c1-21(2)9-8-10-22(3)24-13-15-29(6)26-12-11-25(23(4)19-32)30(16-14-27(33)34-7)20-31(26,30)18-17-28(24,29)5/h9,22,24-26,32H,4,8,10-20H2,1-3,5-7H3

Cluster

Phytochemical cluster
KCF-S cluster No. 831

Link

ChEMBL

By standard InChI CHEMBL557248
By standard InChI Main Layer CHEMBL557248

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Gardenia sootepensis 1233751 Rubiaceae asterids Viridiplantae