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CHEBI:82807 - agrocinopine C

ChEBI IDCHEBI:82807
ChEBI Nameagrocinopine C
Stars
DefinitionA member of the class of agrocinopines that consists of sucrose and D-glucose units joined via a phosphodiester linkage between position 4F of sucrose and position 2 of glucose.
Last Modified28 August 2014
SubmitterSteve
DownloadsMolfile
FormulaC18H33O19P
Net Charge0
Average Mass584.417
Monoisotopic Mass584.13537
SMILESO=P(O)(O[C@H]1[C@@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O)O[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C18H33O19P/c19-1-5-8(23)11(26)13(16(29)32-5)36-38(30,31)37-14-12(27)9(24)6(2-20)33-17(14)35-18(4-22)15(28)10(25)7(3-21)34-18/h5-17,19-29H,1-4H2,(H,30,31)/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16?,17-,18+/m1/s1
InChIKeySLYGSIQCXXPYCD-JGWQWBLKSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
agrocinopine C (CHEBI:82807) has functional parent D-glucopyranose (CHEBI:4167)
agrocinopine C (CHEBI:82807) has functional parent sucrose (CHEBI:17992)
agrocinopine C (CHEBI:82807) has role plant metabolite (CHEBI:76924)
agrocinopine C (CHEBI:82807) is a agrocinopine (CHEBI:82802)
Citations