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CHEBI:193407 - Muricin A

ChEBI IDCHEBI:193407
ChEBI NameMuricin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H64O7
Net Charge0
Average Mass596.890
Monoisotopic Mass596.46520
SMILES[H][C@@]1([C@@H](O)CCCCCCC(O)C(O)CCCCC)CC[C@@H](CCCCCCCCCC[C@@H](O)CC2=C[C@H](C)OC2=O)O1
InChIInChI=1S/C35H64O7/c1-3-4-13-20-31(37)32(38)21-16-11-12-17-22-33(39)34-24-23-30(42-34)19-15-10-8-6-5-7-9-14-18-29(36)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29+,30+,31?,32?,33-,34-/m0/s1
InChIKeyHHCQNIINSIODRY-XSXGYOMISA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Muricin A (CHEBI:193407) is a polyketide (CHEBI:26188)
IUPAC Name 
(2S)-4-[(2R)-2-hydroxy-12-[(2R,5S)-5-[(1S)-1,8,9-trihydroxytetradecyl]oxolan-2-yl]dodecyl]-2-methyl-2H-uran-5-one
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9299959ChemSpider