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CHEBI:85360 - L-dihydroanticapsin

ChEBI IDCHEBI:85360
ChEBI NameL-dihydroanticapsin
Stars
ASCII NameL-dihydroanticapsin
DefinitionAn L-alanine derivative in which one of the methyl hydrogens of L-alanine is replaced by a 5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl group.
Last Modified31 March 2015
SubmitterSteve
DownloadsMolfile
FormulaC9H15NO4
Net Charge0
Average Mass201.222
Monoisotopic Mass201.10011
SMILESN[C@@H](C[C@@H]1CC[C@@H](O)[C@@H]2O[C@H]12)C(=O)O
InChIInChI=1S/C9H15NO4/c10-5(9(12)13)3-4-1-2-6(11)8-7(4)14-8/h4-8,11H,1-3,10H2,(H,12,13)/t4-,5-,6+,7+,8-/m0/s1
InChIKeyYMLXTGCTHGQQKS-TXXZRHAASA-N
Species of MetaboliteComponentSourceComments
Bacillus subtilis (ncbitaxon:1423) - PubMed (23317005)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
L-dihydroanticapsin (CHEBI:85360) has role bacterial metabolite (CHEBI:76969)
L-dihydroanticapsin (CHEBI:85360) is a L-alanine derivative (CHEBI:83943)
L-dihydroanticapsin (CHEBI:85360) is a epoxide (CHEBI:32955)
L-dihydroanticapsin (CHEBI:85360) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
L-dihydroanticapsin (CHEBI:85360) is a oxabicycloalkane (CHEBI:46733)
L-dihydroanticapsin (CHEBI:85360) is a secondary alcohol (CHEBI:35681)
L-dihydroanticapsin (CHEBI:85360) is tautomer of L-dihydroanticapsin zwitterion (CHEBI:84358)
Incoming Relation(s)
L-dihydroanticapsin zwitterion (CHEBI:84358) is tautomer of L-dihydroanticapsin (CHEBI:85360)
IUPAC Name 
3-[(1R,2S,5R,6S )-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]-L-alanine
Manual XrefsDatabases
CPD-17531MetaCyc
Registry NumbersSources
Reaxys:27406393Reaxys
Citations