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CHEBI:209749 - Panclicin E

ChEBI IDCHEBI:209749
ChEBI NamePanclicin E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H49NO5
Net Charge0
Average Mass467.691
Monoisotopic Mass467.36107
SMILESCCCCCCCCCCCC[C@@H]1C(=O)O[C@H]1C[C@H](CCCCCCC)OC(=O)CNC=O
InChIInChI=1S/C27H49NO5/c1-3-5-7-9-10-11-12-13-15-17-19-24-25(33-27(24)31)20-23(18-16-14-8-6-4-2)32-26(30)21-28-22-29/h22-25H,3-21H2,1-2H3,(H,28,29)/t23-,24-,25-/m0/s1
InChIKeyHOPVINBCAGNBQT-SDHOMARFSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7844031)
ChEBI Ontology
Outgoing Relation(s)
Panclicin E (CHEBI:209749) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
[(2S)-1-[(2S,3S)-3-dodecyl-4-oxooxetan-2-yl]nonan-2-yl] 2-ormamidoacetate
Manual XrefsDatabases
7980395ChemSpider