PCIDB

KNApSAcK Metabolite C00043765

Metabolite

KNApSAcK Entry

id C00043765
Name Nephelioside II / (+)-Nephelioside II
CAS RN 656253-23-5
Standard InChI InChI=1S/C47H78O16/c1-42(2)14-16-47(22-50)17-15-45(6)23(24(47)18-42)8-9-29-44(5)12-11-30(43(3,4)28(44)10-13-46(29,45)7)61-41-38(63-40-36(57)34(55)32(53)26(19-48)59-40)37(33(54)27(20-49)60-41)62-39-35(56)31(52)25(51)21-58-39/h8,24-41,48-57H,9-22H2,1-7H3/t24-,25-,26+,27+,28-,29+,30-,31-,32+,33+,34-,35+,36+,37-,38+,39-,40-,41-,44-,45+,46+,47+/m0/s1
Standard InChI (Main Layer) InChI=1S/C47H78O16/c1-42(2)14-16-47(22-50)17-15-45(6)23(24(47)18-42)8-9-29-44(5)12-11-30(43(3,4)28(44)10-13-46(29,45)7)61-41-38(63-40-36(57)34(55)32(53)26(19-48)59-40)37(33(54)27(20-49)60-41)62-39-35(56)31(52)25(51)21-58-39/h8,24-41,48-57H,9-22H2,1-7H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 9

Link

ChEMBL

By standard InChI CHEMBL510267
By standard InChI Main Layer CHEMBL510267

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Sapindaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Nephelium maingayi 1277290 Sapindaceae rosids Viridiplantae