PCIDB

KNApSAcK Metabolite C00050270

Metabolite

KNApSAcK Entry

id C00050270
Name Asterlingulatoside C / (-)-Asterlingulatoside C
CAS RN 191612-09-6
Standard InChI InChI=1S/C52H84O21/c1-22-40(71-42-37(62)32(57)25(54)20-66-42)36(61)39(64)43(68-22)72-41-33(58)26(55)21-67-45(41)73-46(65)52-16-15-47(2,3)17-24(52)23-9-10-29-49(6)13-12-31(70-44-38(63)35(60)34(59)27(19-53)69-44)48(4,5)28(49)11-14-50(29,7)51(23,8)18-30(52)56/h9,22,24-45,53-64H,10-21H2,1-8H3/t22-,24-,25+,26-,27+,28-,29+,30+,31-,32-,33-,34+,35-,36-,37+,38+,39+,40-,41+,42-,43-,44-,45-,49-,50+,51+,52+/m0/s1
Standard InChI (Main Layer) InChI=1S/C52H84O21/c1-22-40(71-42-37(62)32(57)25(54)20-66-42)36(61)39(64)43(68-22)72-41-33(58)26(55)21-67-45(41)73-46(65)52-16-15-47(2,3)17-24(52)23-9-10-29-49(6)13-12-31(70-44-38(63)35(60)34(59)27(19-53)69-44)48(4,5)28(49)11-14-50(29,7)51(23,8)18-30(52)56/h9,22,24-45,53-64H,10-21H2,1-8H3

Cluster

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

Link

ChEMBL

By standard InChI CHEMBL450513
By standard InChI Main Layer CHEMBL450513

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Asteraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Aster lingulatus 41479 Asteraceae asterids Viridiplantae