CHEBI:80662 - mannopine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name mannopine
Definition A hexitol derivative that is D-mannitol in which the hydroxy group at position 1 is replaced by the α-amino group of L-glutamine. It is produced in crown gall tumours induced in a wide range of dicotyledenous plants by Agrobacterium tumefaciens.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11H22N2O8
Net Charge 0
Average Mass 310.30100
Monoisotopic Mass 310.13762
InChI InChI=1S/C11H22N2O8/c12-8(17)2-1-5(11(20)21)13-3-6(15)9(18)10(19)7(16)4-14/h5-7,9-10,13-16,18-19H,1-4H2,(H2,12,17)(H,20,21)/t5-,6+,7+,9+,10+/m0/s1
SMILES NC(=O)CC[C@H](NC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via L-alpha-amino acid )
bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
(via opine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing mannopine (CHEBI:80662) has functional parent D-mannitol (CHEBI:16899)
mannopine (CHEBI:80662) has role plant metabolite (CHEBI:76924)
mannopine (CHEBI:80662) is a L-glutamine derivative (CHEBI:24317)
mannopine (CHEBI:80662) is a amino acid opine (CHEBI:83229)
mannopine (CHEBI:80662) is a dicarboxylic acid monoamide (CHEBI:35735)
mannopine (CHEBI:80662) is a hexitol derivative (CHEBI:63430)
mannopine (CHEBI:80662) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
mannopine (CHEBI:80662) is a secondary amino compound (CHEBI:50995)
Synonyms Sources
1-{[(1S)-4-amino-1-carboxy-4-oxobutyl]amino}-1-deoxy-D-mannitol IUPAC
Nα-(1-D-mannityl)-L-glutamine ChEBI
Manual Xref Database
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Registry Numbers Types Sources
5081463 Reaxys Registry Number Reaxys
87084-52-4 CAS Registry Number KEGG COMPOUND
87084-52-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11386375 PubMed citation Europe PMC
1551843 PubMed citation Europe PMC
1902209 PubMed citation Europe PMC
Last Modified
26 March 2015