PCIDB

KNApSAcK Metabolite C00003510

Metabolite

KNApSAcK Entry

id C00003510
Name Colubrin
CAS RN 87834-09-1
Standard InChI InChI=1S/C48H76O18/c1-22(2)15-24-16-46(8,57)39-25-9-10-30-44(6)13-12-31(43(4,5)29(44)11-14-45(30,7)47(25)20-48(39,66-24)60-21-47)63-41-38(61-23(3)50)36(27(52)19-59-41)64-42-37(34(55)33(54)28(17-49)62-42)65-40-35(56)32(53)26(51)18-58-40/h15,24-42,49,51-57H,9-14,16-21H2,1-8H3/t24-,25+,26+,27-,28?,29-,30+,31-,32-,33+,34-,35?,36-,37?,38?,39-,40-,41-,42-,44-,45+,46-,47-,48-/m0/s1
Standard InChI (Main Layer) InChI=1S/C48H76O18/c1-22(2)15-24-16-46(8,57)39-25-9-10-30-44(6)13-12-31(43(4,5)29(44)11-14-45(30,7)47(25)20-48(39,66-24)60-21-47)63-41-38(61-23(3)50)36(27(52)19-59-41)64-42-37(34(55)33(54)28(17-49)62-42)65-40-35(56)32(53)26(51)18-58-40/h15,24-42,49,51-57H,9-14,16-21H2,1-8H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 32

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08936

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Rhamnaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Colubrina asiatica 106664 Rhamnaceae rosids Viridiplantae