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CHEBI:224695 - Euhalothece-362

ChEBI IDCHEBI:224695
ChEBI NameEuhalothece-362
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22N2O7
Net Charge0
Average Mass330.337
Monoisotopic Mass330.14270
SMILESCOC1=C(N/C=C(/O)CO)C[C@](O)(CO)CC1=N[C@@H](C)C(=O)O
InChIInChI=1S/C14H22N2O7/c1-8(13(20)21)16-11-4-14(22,7-18)3-10(12(11)23-2)15-5-9(19)6-17/h5,8,15,17-19,22H,3-4,6-7H2,1-2H3,(H,20,21)/b9-5+,16-11?/t8-,14+/m0/s1
InChIKeyLFVNAUNRQHDMMU-TWUNJUTQSA-N
Species of MetaboliteComponentSourceComments
Cyanobacterium (ncbitaxon:102234) - PubMed (16630254)
ChEBI Ontology
Outgoing Relation(s)
Euhalothece-362 (CHEBI:224695) is a alanine derivative (CHEBI:22278)
IUPAC Name 
(2S)-2-[[(5R)-3-[[(E)-2,3-dihydroxyprop-1-enyl]amino]-5-hydroxy-5-(hydroxymethyl)-2-methoxycyclohex-2-en-1-ylidene]amino]propanoic acid
Manual XrefsDatabases
78438293ChemSpider