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CHEBI:58587 - gibberellin A19(2−)

Default Structure
ChEBI IDCHEBI:58587
ChEBI Namegibberellin A19(2−)
Stars
ASCII Namegibberellin A19(2-)
DefinitionDicarboxylate anion of gibberellin A19.
Secondary ChEBI IDCHEBI:59508
Last Modified1 July 2015
Submitterrafalcan
DownloadsMolfile
FormulaC20H24O6
Net Charge-2
Average Mass360.406
Monoisotopic Mass360.15839
SMILES[H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(=O)[O-])[C@@]1([H])[C@@]2(C=O)CCC[C@@]1(C)C(=O)[O-]
InChIInChI=1S/C20H26O6/c1-11-8-19-9-20(11,26)7-4-12(19)18(10-21)6-3-5-17(2,16(24)25)14(18)13(19)15(22)23/h10,12-14,26H,1,3-9H2,2H3,(H,22,23)(H,24,25)/p-2/t12-,13+,14+,17+,18+,19-,20-/m0/s1
InChIKeyVNCQCPQAMDQEBY-YTJHIPEWSA-L
ChEBI Ontology
Outgoing Relation(s)
gibberellin A19(2−) (CHEBI:58587) is a gibberellin carboxylic acid anion (CHEBI:59139)
gibberellin A19(2−) (CHEBI:58587) is conjugate base of gibberellin A19 (CHEBI:28731)
Incoming Relation(s)
gibberellin A19 (CHEBI:28731) is conjugate acid of gibberellin A19(2−) (CHEBI:58587)
IUPAC Names 
(1S,2S,3S,4R,8R,9R,12S)-8-formyl-12-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylate
4a-formyl-7α-hydroxy-1-methyl-8-methylidene-4aα,4bβ-gibbane-1α,10β-dicarboxylate
UniProt Name  Source
gibberellin A19UniProt