PCIDB

KNApSAcK Metabolite C00029377

Metabolite

KNApSAcK Entry

id C00029377
Name 11-Deoxymogroside / 11-Dehydroxymogroside III
CAS RN 942612-68-2
Standard InChI InChI=1S/C48H82O18/c1-22(9-13-31(45(4,5)60)66-43-40(59)37(56)34(53)28(64-43)21-61-41-38(57)35(54)32(51)26(19-49)62-41)23-15-16-48(8)29-12-10-24-25(46(29,6)17-18-47(23,48)7)11-14-30(44(24,2)3)65-42-39(58)36(55)33(52)27(20-50)63-42/h10,22-23,25-43,49-60H,9,11-21H2,1-8H3/t22-,23-,25-,26-,27-,28-,29-,30+,31-,32-,33-,34-,35+,36+,37+,38-,39-,40-,41-,42+,43+,46+,47-,48+/m1/s1
Standard InChI (Main Layer) InChI=1S/C48H82O18/c1-22(9-13-31(45(4,5)60)66-43-40(59)37(56)34(53)28(64-43)21-61-41-38(57)35(54)32(51)26(19-49)62-41)23-15-16-48(8)29-12-10-24-25(46(29,6)17-18-47(23,48)7)11-14-30(44(24,2)3)65-42-39(58)36(55)33(52)27(20-50)63-42/h10,22-23,25-43,49-60H,9,11-21H2,1-8H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 11

Link

ChEMBL

By standard InChI CHEMBL227427
By standard InChI Main Layer CHEMBL227427

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 2

Family

family name count
Cucurbitaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Siraitia grosvenori 190522 Cucurbitaceae rosids Viridiplantae
Siraitia grosvenorii 190515 Cucurbitaceae rosids Viridiplantae