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CHEBI:58590 - gibberellin A3(1−)

ChEBI IDCHEBI:58590
ChEBI Namegibberellin A3(1−)
Stars
ASCII Namegibberellin A3(1-)
DefinitionA gibberellin carboxylic acid anion obtained by deprotonation of the carboxy group of gibberellin A3.
Last Modified13 November 2017
DownloadsMolfile
FormulaC19H21O6
Net Charge-1
Average Mass345.371
Monoisotopic Mass345.13436
SMILES[H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(=O)[O-])[C@@]1([H])[C@@]23C=C[C@H](O)[C@@]1(C)C(=O)O3
InChIInChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/p-1/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1
InChIKeyIXORZMNAPKEEDV-OBDJNFEBSA-M
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
gibberellin A3(1−) (CHEBI:58590) has role plant metabolite (CHEBI:76924)
gibberellin A3(1−) (CHEBI:58590) is a gibberellin carboxylic acid anion (CHEBI:59139)
gibberellin A3(1−) (CHEBI:58590) is conjugate base of gibberellin A3 (CHEBI:28833)
Incoming Relation(s)
gibberellin A3 (CHEBI:28833) is conjugate acid of gibberellin A3(1−) (CHEBI:58590)
IUPAC Names 
(1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylate
2β,7α-dihydroxy-1β-methyl-8-methylidene-13-oxo-4a,1α-epoxymethano-4aα,4bβ-gibb-3-ene-10β-carboxylate
UniProt Name  Source
gibberellin A3UniProt