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CHEBI:224438 - 4,9,10-trihydroxy-5-isopropyl-2-methyl-2,3,4,5-tetrahydronaphthalenecarboxylic acid

ChEBI IDCHEBI:224438
ChEBI Name4,9,10-trihydroxy-5-isopropyl-2-methyl-2,3,4,5-tetrahydronaphthalenecarboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O5
Net Charge0
Average Mass280.320
Monoisotopic Mass280.13107
SMILESCC(C)[C@@H]1c2cc(C(=O)O)c(O)c(O)c2[C@@H](C)C[C@@H]1O
InChIInChI=1S/C15H20O5/c1-6(2)11-8-5-9(15(19)20)13(17)14(18)12(8)7(3)4-10(11)16/h5-7,10-11,16-18H,4H2,1-3H3,(H,19,20)/t7-,10-,11+/m0/s1
InChIKeyQEMRNYICMWTEKQ-BKDNQFJXSA-N
Species of MetaboliteComponentSourceComments
Heimiomyces (ncbitaxon:181956) - PubMed (32786884)
ChEBI Ontology
Outgoing Relation(s)
4,9,10-trihydroxy-5-isopropyl-2-methyl-2,3,4,5-tetrahydronaphthalenecarboxylic acid (CHEBI:224438) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(5S,7S,8R)-3,4,7-trihydroxy-5-methyl-8-propan-2-yl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid