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CHEBI:191246 - GA51-catabolite

ChEBI IDCHEBI:191246
ChEBI NameGA51-catabolite
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O5
Net Charge-2
Average Mass328.364
Monoisotopic Mass328.13217
SMILES[H][C@]12CC[C@@]3([H])C4=CC(=O)C[C@@](C)(C(=O)[O-])[C@@]4([H])[C@H](C(=O)[O-])[C@@]3(CC1=C)C2
InChIInChI=1S/C19H22O5/c1-9-6-19-7-10(9)3-4-13(19)12-5-11(20)8-18(2,17(23)24)14(12)15(19)16(21)22/h5,10,13-15H,1,3-4,6-8H2,2H3,(H,21,22)(H,23,24)/p-2/t10-,13+,14-,15-,18-,19+/m1/s1
InChIKeyJBJGOHHQQSPYTO-BLMVKCSQSA-L
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
plant hormone  A plant growth regulator that modulates the formation of stems, leaves and flowers, as well as the development and ripening of fruit. The term includes endogenous and non-endogenous compounds (e.g. active compounds produced by bacteria on the leaf surface) as well as semi-synthetic and fully synthetic compounds.
ChEBI Ontology
Outgoing Relation(s)
GA51-catabolite (CHEBI:191246) is a C19-gibberellin (CHEBI:20858)
GA51-catabolite (CHEBI:191246) is a gibberellin monocarboxylic acid (CHEBI:38305)
IUPAC Name 
(1R,2S,3S,4R,9R,12R)-4-methyl-13-methylidene-6-oxotetracyclo[10.2.1.01,9.03,8]pentadec-7-ene-2,4-dicarboxylate