PCIDB

KNApSAcK Metabolite C00047580

Metabolite

KNApSAcK Entry

id C00047580
Name Sootepin D / (+)-Sootepin D
CAS RN 1154518-97-4
Standard InChI InChI=1S/C31H48O4/c1-21(18-32)8-7-9-22(2)24-12-14-29(5)26-11-10-25(23(3)19-33)30(15-13-27(34)35-6)20-31(26,30)17-16-28(24,29)4/h8,18,22,24-26,33H,3,7,9-17,19-20H2,1-2,4-6H3/b21-8+/t22-,24-,25+,26+,28-,29+,30-,31+/m1/s1
Standard InChI (Main Layer) InChI=1S/C31H48O4/c1-21(18-32)8-7-9-22(2)24-12-14-29(5)26-11-10-25(23(3)19-33)30(15-13-27(34)35-6)20-31(26,30)17-16-28(24,29)4/h8,18,22,24-26,33H,3,7,9-17,19-20H2,1-2,4-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 831

Link

ChEMBL

By standard InChI CHEMBL552070
By standard InChI Main Layer CHEMBL552070

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