PCIDB

KNApSAcK Metabolite C00030002

Metabolite

KNApSAcK Entry

id C00030002
Name Colocynthoside B / (-)-Colocynthoside B
CAS RN 903588-41-0
Standard InChI InChI=1S/C42H62O15/c1-18(16-43)11-20-13-41(7,52)34-24(54-20)14-39(5)26-10-9-21-22(42(26,8)27(45)15-40(34,39)6)12-23(35(51)38(21,3)4)55-37-33(31(49)29(47)25(17-44)56-37)57-36-32(50)30(48)28(46)19(2)53-36/h9,11-12,19-20,22,24-26,28-34,36-37,43-44,46-50,52H,10,13-17H2,1-8H3/b18-11+/t19-,20+,22+,24+,25+,26-,28-,29+,30+,31-,32+,33+,34-,36-,37+,39-,40+,41-,42-/m0/s1
Standard InChI (Main Layer) InChI=1S/C42H62O15/c1-18(16-43)11-20-13-41(7,52)34-24(54-20)14-39(5)26-10-9-21-22(42(26,8)27(45)15-40(34,39)6)12-23(35(51)38(21,3)4)55-37-33(31(49)29(47)25(17-44)56-37)57-36-32(50)30(48)28(46)19(2)53-36/h9,11-12,19-20,22,24-26,28-34,36-37,43-44,46-50,52H,10,13-17H2,1-8H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 675

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Cucurbitaceae 1
Ganodermataceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Citrullus colocynthis (L.) 3653 Cucurbitaceae rosids Viridiplantae
Ganoderma colossum (FR.) C.F.BAKER 5314 Ganodermataceae Fungi