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CHEBI:200993 - Myrocin C

ChEBI IDCHEBI:200993
ChEBI NameMyrocin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O5
Net Charge0
Average Mass344.407
Monoisotopic Mass344.16237
SMILESC=C[C@]1(C)C=C2C(=O)[C@@]3(O)OC(=O)[C@@]4(C)CC[C@H]5C[C@]5([C@H]43)[C@@]2(O)CC1
InChIInChI=1S/C20H24O5/c1-4-16(2)7-8-19(23)12(10-16)13(21)20(24)14-17(3,15(22)25-20)6-5-11-9-18(11,14)19/h4,10-11,14,23-24H,1,5-9H2,2-3H3/t11-,14-,16-,17-,18-,19+,20+/m0/s1
InChIKeyXMHQAXCZBRHGFM-AAORQCPHSA-N
Species of MetaboliteComponentSourceComments
Albifimbria verrucaria (ncbitaxon:1859699) - PubMed (2925513)
ChEBI Ontology
Outgoing Relation(s)
Myrocin C (CHEBI:200993) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(1S,2S,5R,9S,12S,15S,17R)-5-ethenyl-2,9-dihydroxy-5,12-dimethyl-10-oxapentacyclo[7.7.1.01,15.02,7.012,17]heptadec-6-ene-8,11-dione
Manual XrefsDatabases
9243066ChemSpider