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CHEBI:227589 - Cephalosporolide I

ChEBI IDCHEBI:227589
ChEBI NameCephalosporolide I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O6
Net Charge0
Average Mass298.335
Monoisotopic Mass298.14164
SMILESCC1(C)C(=O)O[C@@H]2C[C@@]3(CC[C@@H](CCCC(=O)O)O3)O[C@@H]21
InChIInChI=1S/C15H22O6/c1-14(2)12-10(19-13(14)18)8-15(21-12)7-6-9(20-15)4-3-5-11(16)17/h9-10,12H,3-8H2,1-2H3,(H,16,17)/t9-,10-,12+,15-/m1/s1
InChIKeyIDJLZPUDOCRTJV-DSKWVYQCSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies (ncbitaxon:5081) - DOI (10.1007/bf02978829)
ChEBI Ontology
Outgoing Relation(s)
Cephalosporolide I (CHEBI:227589) is a furofuran (CHEBI:47790)
IUPAC Name 
4-[(2'R,3aR,5R,6aR)-3,3-dimethyl-2-oxospiro[6,6a-dihydro-3aH-uro[3,2-b]uran-5,5'-oxolane]-2'-yl]butanoic acid
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