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CHEBI:219586 - Amycomicin

ChEBI IDCHEBI:219586
ChEBI NameAmycomicin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H29NO5
Net Charge0
Average Mass351.443
Monoisotopic Mass351.20457
SMILES[C-]#[N+][C@@]1(/C=C/C)O[C@H]1[C@@H](O)CCCCC(=O)CCCCCCC(=O)O
InChIInChI=1S/C19H29NO5/c1-3-14-19(20-2)18(25-19)16(22)12-9-8-11-15(21)10-6-4-5-7-13-17(23)24/h3,14,16,18,22H,4-13H2,1H3,(H,23,24)/b14-3+/t16-,18-,19-/m0/s1
InChIKeyAKFABNWZLVRRIF-SVTOFIQFSA-N
Species of MetaboliteComponentSourceComments
Amycolatopsisspecies AA4 (ncbitaxon:1896961) - PubMed (30228116)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Amycomicin (CHEBI:219586) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(13S)-13-hydroxy-13-[(2S,3S)-3-isocyano-3-[(E)-prop-1-enyl]oxiran-2-yl]-8-oxotridecanoic acid