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Gibberellin a1

  • Formula: C19H24O6

  • Molecular weight: 348.40

  • Smiles: CC12C(CCC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O

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Gibberellin a1

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: Gibberellin a1

  • First synonym: Gibberellin a1

  • Synonyms: Gibberellin A1,545-97-1,Gibberellin 1,SCHEMBL676051,CHEBI:27717,ZINC4095479,AKOS026751552,GA1,Q20972182,(1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid,(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-carboxylic acid,2beta,7alpha-dihydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid

Identifiers / External links

Structure

  • Smiles: CC12C(CCC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O

  • Isomeric smiles: C[C@@]12[C@H](CC[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O

  • Inchi: InChI=1S/C19H24O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h10-13,20,24H,1,3-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1

  • Inchikey: JLJLRLWOEMWYQK-OBDJNFEBSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C19H24O6

  • Molecular weight: 348.40

  • Monoisotopic mass: 348.15728848

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