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CHEBI:227620 - Cochlearol P

ChEBI IDCHEBI:227620
ChEBI NameCochlearol P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O7
Net Charge0
Average Mass392.448
Monoisotopic Mass392.18350
SMILESCC1(C)[C@@H](O)CC[C@]2(C)O[C@@](CC(=O)c3cc(O)ccc3O)(C(=O)O)CC[C@@H]12
InChIInChI=1S/C21H28O7/c1-19(2)16-6-9-21(18(26)27,28-20(16,3)8-7-17(19)25)11-15(24)13-10-12(22)4-5-14(13)23/h4-5,10,16-17,22-23,25H,6-9,11H2,1-3H3,(H,26,27)/t16-,17-,20-,21-/m0/s1
InChIKeyVMFJYKZEDLREMS-USNOLKROSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (30947089)
ChEBI Ontology
Outgoing Relation(s)
Cochlearol P (CHEBI:227620) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(2S,4aS,6S,8aS)-2-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-6-hydroxy-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydrochromene-2-carboxylic acid