PCIDB

KNApSAcK Metabolite C00043764

Metabolite

KNApSAcK Entry

id C00043764
Name Nephelioside I
CAS RN 656253-22-4
Standard InChI InChI=1S/C46H76O15/c1-41(2)14-16-46(22-48)17-15-44(6)23(24(46)18-41)8-9-29-43(5)12-11-30(42(3,4)28(43)10-13-45(29,44)7)59-40-37(61-39-35(55)33(53)32(52)27(19-47)58-39)36(26(50)21-57-40)60-38-34(54)31(51)25(49)20-56-38/h8,24-40,47-55H,9-22H2,1-7H3/t24-,25-,26+,27+,28-,29+,30-,31-,32+,33-,34+,35+,36-,37+,38-,39-,40-,43-,44+,45+,46+/m0/s1
Standard InChI (Main Layer) InChI=1S/C46H76O15/c1-41(2)14-16-46(22-48)17-15-44(6)23(24(46)18-41)8-9-29-43(5)12-11-30(42(3,4)28(43)10-13-45(29,44)7)59-40-37(61-39-35(55)33(53)32(52)27(19-47)58-39)36(26(50)21-57-40)60-38-34(54)31(51)25(49)20-56-38/h8,24-40,47-55H,9-22H2,1-7H3

Cluster

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

Link

ChEMBL

By standard InChI CHEMBL488528
By standard InChI Main Layer CHEMBL488528

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