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2,3-Didehydrogibberellin A9

  • Formula: C19H22O4

  • Molecular weight: 314.40

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

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2,3-Didehydrogibberellin A9

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

Names

  • Mycotoxin name: 2,3-Didehydrogibberellin A9

  • First synonym: None

  • Synonyms: 2,3-Didehydrogibberellin A9,2531-21-7,2,3-Dehydro-gibberellin A9,2,3-Didehydro Gibberellin A9,(1R,2R,5R,8R,9S,10R)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-12-ene-9-carboxylic acid,DTXSID20332092,LMPR0104170023

Identifiers / External links

Structure

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

  • Isomeric smiles: CC12C=CC[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@H](C4)C(=C)C5)C(=O)O)OC2=O

  • Inchi: InChI=1S/C19H22O4/c1-10-8-18-9-11(10)4-5-12(18)19-7-3-6-17(2,16(22)23-19)14(19)13(18)15(20)21/h3,6,11-14H,1,4-5,7-9H2,2H3,(H,20,21)/t11-,12-,13-,14-,17?,18+,19-/m1/s1

  • Inchikey: NJHXRWOUQCGQAV-MMZROTCTSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C19H22O4

  • Molecular weight: 314.40

  • Monoisotopic mass: 314.15180918

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