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CHEBI:224537 - KM-01

ChEBI IDCHEBI:224537
ChEBI NameKM-01
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H30O5
Net Charge0
Average Mass398.499
Monoisotopic Mass398.20932
SMILESC=C(C=O)[C@]1(O)C[C@@]2(C)C(=CC1=O)C=C[C@H](OC(=O)/C=C/C=C/[C@@H](C)CC)[C@@H]2C
InChIInChI=1S/C24H30O5/c1-6-16(2)9-7-8-10-22(27)29-20-12-11-19-13-21(26)24(28,17(3)14-25)15-23(19,5)18(20)4/h7-14,16,18,20,28H,3,6,15H2,1-2,4-5H3/b9-7+,10-8+/t16-,18-,20-,23+,24+/m0/s1
InChIKeyGIUVFWDLNFDKHT-PKSNHMFESA-N
Species of MetaboliteComponentSourceComments
Drechslera avenae (ncbitaxon:33199) - DOI (10.1016/0040-4039(94)88331-9)
ChEBI Ontology
Outgoing Relation(s)
KM-01 (CHEBI:224537) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(1R,2S,7R,8aR)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate
Manual XrefsDatabases
10475625ChemSpider