CHEBI:29467 - 2,3-didehydro-gibberellin A9

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,3-didehydro-gibberellin A9
ChEBI ID CHEBI:29467
ChEBI ASCII Name 2,3-didehydro-gibberellin A9
Definition A C19-gibberellin obtained by formal dehydrogenation across the 2,3-position of gibberellin A9.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H22O4
Net Charge 0
Average Mass 314.37560
Monoisotopic Mass 314.15181
InChI InChI=1S/C19H22O4/c1-10-8-18-9-11(10)4-5-12(18)19-7-3-6-17(2,16(22)23-19)14(19)13(18)15(20)21/h3,6,11-14H,1,4-5,7-9H2,2H3,(H,20,21)/t11-,12-,13-,14-,17-,18+,19-/m1/s1
InChIKey NJHXRWOUQCGQAV-YGNOGLJPSA-N
SMILES [H][C@]12CC[C@]3([H])[C@](CC1=C)(C2)[C@@H](C(O)=O)[C@]1([H])[C@@]2(C)C=CC[C@@]31OC2=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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.
(via gibberellin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2,3-didehydro-gibberellin A9 (CHEBI:29467) has functional parent gibberellin A9 (CHEBI:29605)
2,3-didehydro-gibberellin A9 (CHEBI:29467) has role mouse metabolite (CHEBI:75771)
2,3-didehydro-gibberellin A9 (CHEBI:29467) is a C19-gibberellin (CHEBI:20858)
2,3-didehydro-gibberellin A9 (CHEBI:29467) is a gibberellin monocarboxylic acid (CHEBI:38305)
IUPAC Names
(1R,2R,5R,8R,9S,10R,11R)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-12-ene-9-carboxylic acid
1β-methyl-8-methylidene-13-oxo-4a,1α-epoxymethano-4aα,4bβ-gibb-2-ene-10β-carboxylic acid
Synonyms Sources
2,3-Dehydro-gibberellin A9 KEGG COMPOUND
2,3-Didehydro-gibberellin A9 KEGG COMPOUND
Manual Xrefs Databases
C11866 KEGG COMPOUND
LMPR0104170023 LIPID MAPS
View more database links
Registry Numbers Types Sources
1398580 Beilstein Registry Number Beilstein
2531-21-7 CAS Registry Number KEGG COMPOUND
8941399 Reaxys Registry Number Reaxys
Last Modified
27 January 2016