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Gibberellin a13

  • Formula: C20H26O7

  • Molecular weight: 378.40

  • Smiles: CC1(C(CCC2(C1C(C34C2CCC(C3)C(=C)C4)C(=O)O)C(=O)O)O)C(=O)O

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Gibberellin a13

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

Names

  • Mycotoxin name: Gibberellin a13

  • First synonym: Gibberellin a13

  • Synonyms: Gibberellin A13,GA13,2922-24-9,(1alpha,2beta,4aalpha,4bbeta,10beta)-2-hydroxy-1-methyl-8-methylenegibbane-1,4a,10-tricarboxylic acid,(1R,2S,3S,4S,5S,8R,9R,12R)-5-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid,(1S,2S,4aR,4bR,7R,9aR,10S,10aS)-2-hydroxy-1-methyl-8-methylenedodecahydro-4aH-7,9a-methanobenzo[a]azulene-1,4a,10-tricarboxylic acid,SCHEMBL10779830,CHEBI:72598,Q27140004

Identifiers / External links

Structure

  • Smiles: CC1(C(CCC2(C1C(C34C2CCC(C3)C(=C)C4)C(=O)O)C(=O)O)O)C(=O)O

  • Isomeric smiles: C[C@]1([C@H](CC[C@@]2([C@@H]1[C@@H]([C@]34[C@H]2CC[C@H](C3)C(=C)C4)C(=O)O)C(=O)O)O)C(=O)O

  • Inchi: InChI=1S/C20H26O7/c1-9-7-19-8-10(9)3-4-11(19)20(17(26)27)6-5-12(21)18(2,16(24)25)14(20)13(19)15(22)23/h10-14,21H,1,3-8H2,2H3,(H,22,23)(H,24,25)(H,26,27)/t10-,11-,12+,13-,14-,18-,19+,20-/m1/s1

  • Inchikey: UYRCHWLYXIQJKK-HMRRIYTKSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C20H26O7

  • Molecular weight: 378.40

  • Monoisotopic mass: 378.16785316

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