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CHEBI:181498 - Gliocladic acid

ChEBI IDCHEBI:181498
ChEBI NameGliocladic acid
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SubmitterMetaboLights
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FormulaC14H22O4
Net Charge0
Average Mass254.326
Monoisotopic Mass254.15181
SMILESCC(C)[C@H]1CCC(CO)=C[C@@H]1/C=C(\CO)C(=O)O
InChIInChI=1S/C14H22O4/c1-9(2)13-4-3-10(7-15)5-11(13)6-12(8-16)14(17)18/h5-6,9,11,13,15-16H,3-4,7-8H2,1-2H3,(H,17,18)/b12-6+/t11-,13-/m1/s1
InChIKeySLVSUVFUFJKMCV-URFGDBDFSA-N
ChEBI Ontology
Outgoing Relation(s)
Gliocladic acid (CHEBI:181498) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name 
(E)-2-(hydroxymethyl)-3-[(1R,6R)-3-(hydroxymethyl)-6-propan-2-ylcyclohex-2-en-1-yl]prop-2-enoic acid
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