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CHEBI:58256 - α-cyclopiazonate

ChEBI IDCHEBI:58256
ChEBI Nameα-cyclopiazonate
Stars
ASCII Namealpha-cyclopiazonate
DefinitionAn organic anion that is the conjugate base of α-cyclopiazonic acid; major species at pH 7.3.
Last Modified23 October 2012
DownloadsMolfile
FormulaC20H19N2O3
Net Charge-1
Average Mass335.383
Monoisotopic Mass335.14012
SMILES[H][C@]12c3cnc4cccc(c34)C[C@@]1([H])C(C)(C)N1C(=O)/C(=C(/C)[O-])C(=O)[C@@]12[H]
InChIInChI=1S/C20H20N2O3/c1-9(23)14-18(24)17-16-11-8-21-13-6-4-5-10(15(11)13)7-12(16)20(2,3)22(17)19(14)25/h4-6,8,12,16-17,21,23H,7H2,1-3H3/p-1/b14-9-/t12-,16+,17+/m1/s1
InChIKeyCNZIQHGDUXRUJS-PTNHGACKSA-M
ChEBI Ontology
Outgoing Relation(s)
α-cyclopiazonate (CHEBI:58256) is a organic anion (CHEBI:25696)
α-cyclopiazonate (CHEBI:58256) is conjugate base of α-cyclopiazonic acid (CHEBI:17734)
Incoming Relation(s)
α-cyclopiazonic acid (CHEBI:17734) is conjugate acid of α-cyclopiazonate (CHEBI:58256)
IUPAC Name 
(1Z)-1-[(6aR,11aS,11bR)-7,7-dimethyl-9,11-dioxo-2,6a,7,11,11a,11b-hexahydro-6H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-10(9H)-ylidene]ethanolate
Synonyms  Source
α-cyclopiazonate(1−)ChEBI
α-cyclopiazonate anionChEBI
UniProt Name  Source
α-cyclopiazonateUniProt