PCIDB

KNApSAcK Metabolite C00033826

Metabolite

KNApSAcK Entry

id C00033826
Name Eryngioside D / (+)-Eryngioside D
CAS RN 1039557-66-8
Standard InChI InChI=1S/C54H90O24/c1-49(2)14-23-22-8-9-29-51(5)12-11-32(50(3,4)28(51)10-13-52(29,6)53(22,7)16-31(60)54(23,30(59)15-49)21-71-45-41(69)37(65)33(61)24(17-55)72-45)76-47-43(39(67)35(63)26(19-57)74-47)78-48-44(40(68)36(64)27(20-58)75-48)77-46-42(70)38(66)34(62)25(18-56)73-46/h8,23-48,55-70H,9-21H2,1-7H3/t23-,24+,25+,26+,27+,28-,29+,30-,31+,32-,33+,34-,35+,36+,37-,38-,39-,40-,41+,42+,43+,44+,45+,46-,47?,48-,51-,52+,53+,54+/m0/s1
Standard InChI (Main Layer) InChI=1S/C54H90O24/c1-49(2)14-23-22-8-9-29-51(5)12-11-32(50(3,4)28(51)10-13-52(29,6)53(22,7)16-31(60)54(23,30(59)15-49)21-71-45-41(69)37(65)33(61)24(17-55)72-45)76-47-43(39(67)35(63)26(19-57)74-47)78-48-44(40(68)36(64)27(20-58)75-48)77-46-42(70)38(66)34(62)25(18-56)73-46/h8,23-48,55-70H,9-21H2,1-7H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 4

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
Apiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Eryngium yuccifolium 90460 Apiaceae asterids Viridiplantae