CHEBI:29601 - gibberellin A53 aldehyde

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ChEBI Name gibberellin A53 aldehyde
ChEBI ID CHEBI:29601
ChEBI ASCII Name gibberellin A53 aldehyde
Definition A C20-gibberellin obtained by selective reduction of the 10β-carboxy group of gibberellin A53.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000004102236
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Formula C20H28O4
Net Charge 0
Average Mass 332.43392
Monoisotopic Mass 332.19876
InChI InChI=1S/C20H28O4/c1-12-9-19-11-20(12,24)8-5-14(19)17(2)6-4-7-18(3,16(22)23)15(17)13(19)10-21/h10,13-15,24H,1,4-9,11H2,2-3H3,(H,22,23)/t13-,14-,15-,17-,18+,19+,20-/m0/s1
InChIKey DHEPJQQWDJWPJY-XQIDNCIUSA-N
SMILES [H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C=O)[C@]1([H])[C@@](C)(CCC[C@@]21C)C(O)=O
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 A53 aldehyde (CHEBI:29601) has functional parent gibberellin A53 (CHEBI:27433)
gibberellin A53 aldehyde (CHEBI:29601) is a C20-gibberellin (CHEBI:20859)
gibberellin A53 aldehyde (CHEBI:29601) is a gibberellin monocarboxylic acid (CHEBI:38305)
IUPAC Names
(1S,2S,3S,4R,8S,9S,12S)-2-formyl-12-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-4-carboxylic acid
10β-formyl-7-hydroxy-1β,4a-dimethyl-8-methylidene-4aα,4bβ-gibbane-1α-carboxylic acid
Synonym Source
Gibberellin A53 aldehyde KEGG COMPOUND
Manual Xrefs Databases
C11905 KEGG COMPOUND
LMPR0104170029 LIPID MAPS
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Registry Numbers Types Sources
5121643 Reaxys Registry Number Reaxys
85344-33-8 CAS Registry Number KEGG COMPOUND
Last Modified
17 August 2011