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CHEBI:73250 - gibberellin A1 methyl ester

ChEBI IDCHEBI:73250
ChEBI Namegibberellin A1 methyl ester
Stars
ASCII Namegibberellin A1 methyl ester
DefinitionA gibberellin ester that is the methyl ester of gibberellin A1.
Last Modified6 September 2018
SubmitterKAX
DownloadsMolfile
FormulaC20H26O6
Net Charge0
Average Mass362.422
Monoisotopic Mass362.17294
SMILES[H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(=O)OC)[C@@]1([H])[C@@]23CC[C@H](O)[C@@]1(C)C(=O)O3
InChIInChI=1S/C20H26O6/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/h11-14,21,24H,1,4-9H2,2-3H3/t11-,12+,13-,14-,17-,18+,19+,20-/m1/s1
InChIKeyOHIXAJDQAXXFTE-QDEMZEMRSA-N
ChEBI Ontology
Outgoing Relation(s)
gibberellin A1 methyl ester (CHEBI:73250) has functional parent gibberellin A1 (CHEBI:27717)
gibberellin A1 methyl ester (CHEBI:73250) is a gibberellin ester (CHEBI:73268)
gibberellin A1 methyl ester (CHEBI:73250) is a lactone (CHEBI:25000)
gibberellin A1 methyl ester (CHEBI:73250) is a methyl ester (CHEBI:25248)
gibberellin A1 methyl ester (CHEBI:73250) is a organic heteropentacyclic compound (CHEBI:38164)
gibberellin A1 methyl ester (CHEBI:73250) is a secondary alcohol (CHEBI:35681)
gibberellin A1 methyl ester (CHEBI:73250) is a tertiary alcohol (CHEBI:26878)
Incoming Relation(s)
gibberellin A34 methyl ester (CHEBI:73260) has functional parent gibberellin A1 methyl ester (CHEBI:73250)
IUPAC Name 
methyl (1S,2S,4aR,4bR,7S,9aS,10S,10aR)-2,7-dihydroxy-1-methyl-8-methylene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylate
Synonyms  Source
GA1 methyl esterChEBI
methyl 2β,7α-dihydroxy-1β-methyl-8-methylidene-13-oxo-4a,1α-epoxymethano-4aα,4bβ-gibbane-10β-carboxylateChEBI
MeGA1ChEBI
UniProt Name  Source
O-methyl gibberellin A1UniProt
Registry NumbersSources
Reaxys:96902Reaxys
Citations