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CHEBI:224423 - Heimiomycin A

ChEBI IDCHEBI:224423
ChEBI NameHeimiomycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H28O7
Net Charge0
Average Mass476.525
Monoisotopic Mass476.18350
SMILESCC(C)[C@H]1CC[C@H](C)c2c(O)c(O)c(C=O)c(-c3c(O)cc(/C=C/c4ccc(O)cc4)oc3=O)c21
InChIInChI=1S/C28H28O7/c1-14(2)19-11-4-15(3)22-23(19)24(20(13-29)26(32)27(22)33)25-21(31)12-18(35-28(25)34)10-7-16-5-8-17(30)9-6-16/h5-10,12-15,19,30-33H,4,11H2,1-3H3/b10-7+/t15-,19+/m0/s1
InChIKeyLMLHRSCJBYWBPI-BJPUREHHSA-N
Species of MetaboliteComponentSourceComments
Heimiomyces (ncbitaxon:181956) - PubMed (32786884)
ChEBI Ontology
Outgoing Relation(s)
Heimiomycin A (CHEBI:224423) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(5S,8R)-3,4-dihydroxy-1-[4-hydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-oxopyran-3-yl]-5-methyl-8-propan-2-yl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde