- Recommended name
- Azaspiracid-21
- Synonyms
- n/a
- Recommended acronym
- AZA-21
- Abbreviation
Progenitors
No progenitors registered
Vector Species
- Name
- Mytilus edulis
- Note
- AZA-21 is a shellfish metabolite of AZA-1
References
- Rehmann, Nils, 2008
- First report
- Kilcoyne et al., 2018
- Shellfish metabolism of AZAs
- Structure
-
- Formula
- C47H69NO15
- Exact mono-isotopic mass
- 887.46672
- Molfile
- see other chem files
- Alternative molfiles
- n/a
- SMILES
- C=C([C@]4([H])[C@@H](C)CC(C(O)=O)[C@@]([C@H](O)[C@]5([H])C[C@](O[C@@]7(CC[C@]8(CC=C[C@](/C=C/C(O)CC(O)=O)([H])O8)O7)[C@H](C)C6)([H])[C@]6([H])O5)(O)O4)C[C@](O3)(O9)C[C@@H](C)C[C@@H]9[C@@]([C@@]3([H])C2)([H])O[C@@]12[C@@H](C)C[C@@H](C)CN1.[*].[B].[C].[2H].[F].[H].[I]
- Alternative SMILES
- n/a
- InChi key
- Alternative InChi keys
- n/a
- InChi
- Alternative InChis
- Spectra available
- True
- Chem files
- chemfiles/AZA-21.cdx chemfiles/AZA-21.mol
References
- Rehmann et al., 2008
- structure
- Certified
- False
- Certified links
-
-
n/a
- Non certified reference material
- False
Chemical analysis
- Research
- True
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
Structure recognition assays
- Research
- Unknown
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
Functional assays
- Research
- Unknown
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
Animal assays
- Research
- Unknown
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
References
- Rehmann, Nils, 2008
- LC-MS/MS method
- Regulatory status
- False
- Human toxic syndrome(s)
- Azaspiracid Shellfish Poisoning
- Organ system toxicity
- Gastro-intestinal toxicity
- Risk assessment
- Unknown
- Molecular targets known
- Unknown
- Molecular targets
- n/a
- Toxic to aquatic animals
- Unknown
- TEF available
- False
- Notes
- Bernd Krock
- Contact