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CHEBI:10092 - Yiamoloside B

ChEBI IDCHEBI:10092
ChEBI NameYiamoloside B
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC43H68O15
Net Charge0
Average Mass825.002
Monoisotopic Mass824.45582
SMILES[H][C@]12CC=C3[C@]4([H])C[C@@](C)(C(=O)OC)CC[C@]4(C(=O)O)CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)CC[C@]21C
InChIInChI=1S/C43H68O15/c1-38(2)25-10-13-42(6)26(9-8-21-22-18-39(3,37(53)54-7)14-16-43(22,36(51)52)17-15-41(21,42)5)40(25,4)12-11-27(38)57-34-32(50)30(48)33(24(20-45)56-34)58-35-31(49)29(47)28(46)23(19-44)55-35/h8,22-35,44-50H,9-20H2,1-7H3,(H,51,52)/t22-,23+,24+,25-,26+,27-,28-,29-,30+,31+,32+,33-,34-,35-,39-,40-,41+,42+,43-/m0/s1
InChIKeyIDTIOCYBMWJUGJ-JEEHKKCPSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Yiamoloside B (CHEBI:10092) is a triterpenoid saponin (CHEBI:61778)
Synonym  Source
Yiamoloside BKEGG COMPOUND
Manual XrefsDatabases
C08990KEGG COMPOUND
C00003560KNApSAcK
Registry NumbersSources
CAS:80311-28-0KEGG COMPOUND