CHEBI:28085 - β-mannobiose

ChEBI IDCHEBI:28085
ChEBI Nameβ-mannobiose
Stars
ASCII Namebeta-mannobiose
DefinitionThe β-isomer of mannobiose.
Secondary ChEBI IDsCHEBI:6687, CHEBI:43994
Last Modified7 April 2021
DownloadsMolfile
FormulaC12H22O11
Net Charge0
Average Mass342.297
Monoisotopic Mass342.11621
SMILESOC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@H](O)O[C@@H]2CO)[C@@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/1,2,1/[a1122h-1b_1-5]/1-1/a4-b1
InChIInChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8+,9+,10-,11-,12+/m1/s1
InChIKeyGUBGYTABKSRVRQ-PZPXDAEZSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
β-mannobiose (CHEBI:28085) is a mannobiose (CHEBI:25164)
Incoming Relation(s)
β-D-Manp-(1→4)-β-D-Manp-(1→3)-D-Manp (CHEBI:148215) has functional parent β-mannobiose (CHEBI:28085)
IUPAC Name 
β-D-mannopyranosyl-(1→4)-β-D-mannopyranose
Synonyms  Source
4-O-β-D-mannopyranosyl-β-D-mannopyranoseIUPAC
MannobioseKEGG COMPOUND
MANNOBIOSEPDBeChem
Manual XrefsDatabases
C01728KEGG COMPOUND
CPD-16553MetaCyc
DB01687DrugBank
G78317QOGlyGen
G78317QOGlyTouCan
HMDB0029933HMDB
MABPDBeChem
Registry NumbersSources
Reaxys:90836Reaxys