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CHEBI:214542 - Synechobactin C

ChEBI IDCHEBI:214542
ChEBI NameSynechobactin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H40N4O9
Net Charge0
Average Mass504.581
Monoisotopic Mass504.27953
SMILESCCCCCCCC(=O)N(O)CCCNC(=O)C[C@@](O)(CC(=O)NCCCN(O)C(C)=O)C(=O)O
InChIInChI=1S/C22H40N4O9/c1-3-4-5-6-7-10-20(30)26(35)14-9-12-24-19(29)16-22(33,21(31)32)15-18(28)23-11-8-13-25(34)17(2)27/h33-35H,3-16H2,1-2H3,(H,23,28)(H,24,29)(H,31,32)/t22-/m0/s1
InChIKeyLPWDCGVTZOZWBF-QFIPXVFZSA-N
Species of MetaboliteComponentSourceComments
Synechococcusspecies PCC 7002 (ncbitaxon:32049) - DOI (10.4319/lo.2005.50.6.1918)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Synechobactin C (CHEBI:214542) is a hydroxy fatty acid (CHEBI:24654)
IUPAC Name 
2-[2-[3-[acetyl(hydroxy)amino]propylamino]-2-oxoethyl]-2-hydroxy-4-[3-[hydroxy(octanoyl)amino]propylamino]-4-oxobutanoic acid
Manual XrefsDatabases
10481006ChemSpider