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CHEBI:224433 - Heimiomycin C

ChEBI IDCHEBI:224433
ChEBI NameHeimiomycin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24O6
Net Charge0
Average Mass384.428
Monoisotopic Mass384.15729
SMILESCC1=CC(=O)C(c2c(C=O)c(O)c(O)c3c2[C@@H](C(C)C)CC[C@@H]3C)=C(O)C1=O
InChIInChI=1S/C22H24O6/c1-9(2)12-6-5-10(3)15-16(12)17(13(8-23)20(26)21(15)27)18-14(24)7-11(4)19(25)22(18)28/h7-10,12,26-28H,5-6H2,1-4H3/t10-,12+/m0/s1
InChIKeyNAMRVMWYSKEEBE-CMPLNLGQSA-N
Species of MetaboliteComponentSourceComments
Heimiomyces (ncbitaxon:181956) - PubMed (32786884)
ChEBI Ontology
Outgoing Relation(s)
Heimiomycin C (CHEBI:224433) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(5S,8R)-3,4-dihydroxy-1-(2-hydroxy-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)-5-methyl-8-propan-2-yl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde