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CHEBI:179837 - (+)-Hirusten-12-oic acid

Default Structure
ChEBI IDCHEBI:179837
ChEBI Name(+)-Hirusten-12-oic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O5
Net Charge0
Average Mass280.320
Monoisotopic Mass280.13107
SMILES[H][C@]12C[C@](C)(OC(=O)O)C[C@@]1([H])[C@]1(C)C(=C)[C@@H](O)[C@@]3([H])O[C@@]13C2
InChIInChI=1S/C15H20O5/c1-7-10(16)11-15(19-11)5-8-4-13(2,20-12(17)18)6-9(8)14(7,15)3/h8-11,16H,1,4-6H2,2-3H3,(H,17,18)/t8-,9-,10-,11-,13+,14+,15-/m1/s1
InChIKeyLCFUOWBIHPHLEN-BLYYJXBTSA-N
ChEBI Ontology
Outgoing Relation(s)
(+)-Hirusten-12-oic acid (CHEBI:179837) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(1S,3R,5S,7R,8R,10R,11R)-10-hydroxy-5,8-dimethyl-9-methylidene-12-oxatetracyclo[6.4.0.01,11.03,7]dodecan-5-yl] hydrogen carbonate
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