PCIDB

KNApSAcK Metabolite C00029922

Metabolite

KNApSAcK Entry

id C00029922
Name Cesdiurin I / (-)-Cesdiurin I
CAS RN 1071987-36-4
Standard InChI InChI=1S/C46H74O20/c1-19(18-60-41-36(56)33(53)30(50)25(15-47)62-41)8-13-46(59-5)20(2)28-40(66-46)32(52)29-23-7-6-21-14-22(9-11-44(21,3)24(23)10-12-45(28,29)4)61-42-38(58)35(55)39(27(17-49)64-42)65-43-37(57)34(54)31(51)26(16-48)63-43/h6,20,22-43,47-58H,1,7-18H2,2-5H3/t20-,22-,23+,24-,25+,26+,27+,28-,29+,30+,31+,32-,33-,34-,35+,36+,37+,38+,39-,40+,41+,42+,43-,44-,45+,46+/m0/s1
Standard InChI (Main Layer) InChI=1S/C46H74O20/c1-19(18-60-41-36(56)33(53)30(50)25(15-47)62-41)8-13-46(59-5)20(2)28-40(66-46)32(52)29-23-7-6-21-14-22(9-11-44(21,3)24(23)10-12-45(28,29)4)61-42-38(58)35(55)39(27(17-49)64-42)65-43-37(57)34(54)31(51)26(16-48)63-43/h6,20,22-43,47-58H,1,7-18H2,2-5H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 17

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
Solanaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cestrum diurnum L 103474 Solanaceae asterids Viridiplantae