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CHEBI:73253 - gibberellin A3 methyl ester

ChEBI IDCHEBI:73253
ChEBI Namegibberellin A3 methyl ester
Stars
ASCII Namegibberellin A3 methyl ester
DefinitionA gibberellin ester that is the methyl ester of gibberellin A3.
Last Modified30 March 2015
SubmitterKAX
DownloadsMolfile
FormulaC20H24O6
Net Charge0
Average Mass360.406
Monoisotopic Mass360.15729
SMILES[H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(=O)OC)[C@@]1([H])[C@@]23C=C[C@H](O)[C@@]1(C)C(=O)O3
InChIInChI=1S/C20H24O6/c1-10-8-18-9-19(10,24)6-4-11(18)20-7-5-12(21)17(2,16(23)26-20)14(20)13(18)15(22)25-3/h5,7,11-14,21,24H,1,4,6,8-9H2,2-3H3/t11-,12+,13-,14-,17-,18+,19+,20-/m1/s1
InChIKeyDCYKYFYDBJFJHO-QDEMZEMRSA-N
ChEBI Ontology
Outgoing Relation(s)
gibberellin A3 methyl ester (CHEBI:73253) has functional parent gibberellin A3 (CHEBI:28833)
gibberellin A3 methyl ester (CHEBI:73253) is a gibberellin ester (CHEBI:73268)
gibberellin A3 methyl ester (CHEBI:73253) is a lactone (CHEBI:25000)
gibberellin A3 methyl ester (CHEBI:73253) is a methyl ester (CHEBI:25248)
gibberellin A3 methyl ester (CHEBI:73253) is a organic heteropentacyclic compound (CHEBI:38164)
gibberellin A3 methyl ester (CHEBI:73253) is a secondary alcohol (CHEBI:35681)
gibberellin A3 methyl ester (CHEBI:73253) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
methyl (1S,2S,4aR,4bR,7S,9aS,10S,10aR)-2,7-dihydroxy-1-methyl-8-methylene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylate
Synonyms  Source
GA3 methyl esterChEBI
methyl 2β,7α-dihydroxy-1β-methyl-8-methylidene-13-oxo-4a,1α-epoxymethano-4aα,4bβ-gibb-3-ene-10β-carboxylateChEBI
UniProt Name  Source
O-methyl gibberellin A3UniProt
Registry NumbersSources
Reaxys:1300143Reaxys
Citations