Logo Anses
Logo Interreg

Gibberellin a12 aldehyde

  • Formula: C20H28O3

  • Molecular weight: 316.40

  • Smiles: CC12CCCC(C1C(C34C2CCC(C3)C(=C)C4)C=O)(C)C(=O)O

Download

Gibberellin a12 aldehyde

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

Names

  • Mycotoxin name: Gibberellin a12 aldehyde

  • First synonym: Gibberellin a12 aldehyde

  • Synonyms: Gibberellin A12 aldehyde,Gibberellin-A-12-aldehyde,GA12-aldehyde,19436-07-8,(1alpha,4aalpha,4bbeta,10beta)-10-formyl-1,4a-dimethyl-8-methylene-gibbane-1-carboxylic acid,(1R,2S,3S,4R,8S,9S,12R)-2-formyl-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0(1,9).0(3,8)]pentadecane-4-carboxylic acid 10beta-formyl-1beta,4a-dimethyl-8-methylidene-4aalpha,4bbeta-gibbane-1alpha-carboxylic acid,(1R,4aS,4bS,7R,9aR,10S,10aS)-10-formyl-1,4a-dimethyl-8-methylenedodecahydro-1H-7,9a-methanobenzo[a]azulene-1-carboxylic acid,Gibberellin A12 7-aldehyde,SCHEMBL5557371,CHEBI:15610,LMPR0104170040,Q27098143,10beta-formyl-1beta,4a-dimethyl-8-methylidene-4aalpha,4bbeta-gibbane-1alpha-carboxylic acid,(1alpha,4aalpha,4bbeta,10beta)-10-formyl-1,4a-dimethyl-8-methylenegibbane-1-carboxylic acid,(1R,2S,3S,4R,8S,9S,12R)-2-formyl-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0(1,9).0(3,8)]pentadecane-4-carboxylic acid

Identifiers / External links

Structure

  • Smiles: CC12CCCC(C1C(C34C2CCC(C3)C(=C)C4)C=O)(C)C(=O)O

  • Isomeric smiles: C[C@@]12CCC[C@@]([C@H]1[C@@H]([C@]34[C@H]2CC[C@H](C3)C(=C)C4)C=O)(C)C(=O)O

  • Inchi: InChI=1S/C20H28O3/c1-12-9-20-10-13(12)5-6-15(20)18(2)7-4-8-19(3,17(22)23)16(18)14(20)11-21/h11,13-16H,1,4-10H2,2-3H3,(H,22,23)/t13-,14+,15+,16+,18+,19-,20-/m1/s1

  • Inchikey: ZCTUNYRXJKLWPY-LLCOKINKSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C20H28O3

  • Molecular weight: 316.40

  • Monoisotopic mass: 316.20384475

Select an endpoint:

Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Sub category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Endpoint Tool Value Unit Comments Reference

Fungi