CHEBI:175439 - Gibberellin A112

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ChEBI Name Gibberellin A112
ChEBI ID CHEBI:175439
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H28O5
Net Charge 0
Average Mass 348.439
Monoisotopic Mass 348.19367
InChI InChI=1S/C20H28O5/c1-10-8-20-9-11(10)12(21)7-13(20)18(2)5-4-6-19(3,17(24)25)15(18)14(20)16(22)23/h11-15,21H,1,4-9H2,2-3H3,(H,22,23)(H,24,25)/t11-,12-,13+,14-,15+,18+,19-,20+/m1/s1
InChIKey RVQCZHZIMZMGAD-MDZZOIHRSA-N
SMILES O[C@H]1[C@@]2(C[C@]3([C@]([C@]4([C@]([C@@H]3C(O)=O)([C@](CCC4)(C)C(O)=O)[H])C)(C1)[H])CC2=C)[H]
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): 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 Gibberellin A112 (CHEBI:175439) is a C20-gibberellin (CHEBI:20859)
IUPAC Name
(1R,2S,3S,4R,8S,9S,11R,12R)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
Manual Xref Database
103884044 ChemSpider
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