- Recommended name
- Dinophysistoxin-2
- Synonyms
- Dinophysistoxin 2
- Recommended acronym
- DTX2
- Abbreviation
Progenitors
No progenitors registered
Vector Species
No vector species registered
- Structure
-
- Formula
- C44H68O13
- Exact mono-isotopic mass
- 804.46599
- Molfile
- Untitled ACS Document 1996-1 ChemDraw02162322312D 57 63 0 0 1 0 0 0 0 0999 V2000 -6.4847 -0.0011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4847 -0.8617 0.0000 C 0
- Alternative molfiles
- n/a
- SMILES
- OC([C@](C)(O)C[C@@H]1CC[C@@H](O)[C@@]2(O[C@H]([C@H](C)/C=C/[C@@H]3O[C@]4(CC[C@@H](O[C@H]([C@@H](O)C[C@H](C)[C@H]5O[C@@]6([C@@H](C)CCCO6)CCC5)C([C@H]7O)=C)[C@H]7O4)CC3)CC(C)=C2)O1)=O
- Alternative SMILES
- OC([C](C)(O)C[CH]1CC[CH](O)[C]2(O[CH]([CH](C)/C=C/[CH]3O[C]4(CC[CH](O[CH]([CH](O)C[CH](C)[CH]5O[C]6([CH](C)CCCO6)CCC5)C([CH]7O)=C)[CH]7O4)CC3)CC(C)=C2)O1)=O
- InChi key
- BRFKTXCAUCYQBT-AKHROESGSA-N
- Alternative InChi keys
- n/a
- InChi
- InChI=1S/C44H68O13/c1-25-21-35(56-44(23-25)36(46)14-13-31(54-44)24-41(6,50)40(48)49)26(2)11-12-30-15-18-42(53-30)19-16-34-39(57-42)37(47)29(5)38(52-34)32(45)22-27(3)33-10-7-17-43(55-33)28(4)9-8-20-51-43/h11-12,23,26-28,30-39,45-47,50H,5,7-10,13-22,24
- Alternative InChis
- Spectra available
- True
- Chem files
- Certified
- True
- Certified links
-
-
n/a
- Non certified reference material
- Unknown
Chemical analysis
- Research
- True
- Standardized
- True
- Validated
- True
- Official
- n/a
Structure recognition assays
- Research
- True
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
Functional assays
- Research
- True
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
Animal assays
- Research
- True
- Standardized
- Unknown
- Validated
- Unknown
- Official
- n/a
- Regulatory status
- True
- Human toxic syndrome(s)
- Diarrhetic Shellfish Poisoning
- Organ system toxicity
- Gastro-intestinal toxicity
- Risk assessment
- True
- Molecular targets known
- True
- Molecular targets
- Protein phosphatase 2A, Protein phosphatase 1
- Toxic to aquatic animals
- Unknown
- TEF available
- True
- Notes
- CAS seems to have the old (incorrect) structure in its database, with the stereochemistry at C-35 being incorrect (it is 35S, not 35R).