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CHEBI:216255 - Helotialin A

ChEBI IDCHEBI:216255
ChEBI NameHelotialin A
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FormulaC23H30O6
Net Charge0
Average Mass402.487
Monoisotopic Mass402.20424
SMILESCCCCCCC/C=C/C(=O)C[C@@H]1C2=COC(C)=CC2=C(C(=O)O)C(=O)[C@]1(C)O
InChIInChI=1S/C23H30O6/c1-4-5-6-7-8-9-10-11-16(24)13-19-18-14-29-15(2)12-17(18)20(22(26)27)21(25)23(19,3)28/h10-12,14,19,28H,4-9,13H2,1-3H3,(H,26,27)/b11-10+/t19-,23-/m1/s1
InChIKeyKPENYWVACGTNKL-OTXYMOGGSA-N
ChEBI Ontology
Outgoing Relation(s)
Helotialin A (CHEBI:216255) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(7R,8R)-7-hydroxy-3,7-dimethyl-6-oxo-8-[(E)-2-oxoundec-3-enyl]-8H-isochromene-5-carboxylic acid
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