- Recommended name
- Brevetoxin A
- Synonyms
- n/a
- Recommended acronym
- BTX-1
- Abbreviation
Progenitors
No progenitors registered
Vector Species
No vector species registered
- Structure
-
- Formula
- C49H70O13
- Exact mono-isotopic mass
- 866.4816
- Molfile
- n/a
- Alternative molfiles
- n/a
- SMILES
- O=C1O[C@@]2([H])C[C@@H](C)C[C@]3(C)[C@@](C[C@](O[C@](C/C=C\C[C@](O[C@](CCC[C@](O[C@](C[C@](O[C@H](CC(C=O)=C)C[C@@H]4O)([H])[C@@]4([H])O5)([H])[C@@]5([H])C6)([H])[C@@]6(C)O7)([H])[C@@]7([H])/C=C\C8)([H])[C@@]8([H])O9)([H])[C@@]9([H])[C@@H](C)C%10)([H])[C@@]%10([H])O3)([H])O[C@]2([H])C1
- Alternative SMILES
- n/a
- InChi key
- MGVIMUPHKPHTKF-HQUFVKSZSA-N
- Alternative InChi keys
- n/a
- InChi
- InChI=1S/C49H70O13/c1-26-17-36-39(22-45(52)58-36)57-44-21-38-40(62-48(44,4)23-26)18-28(3)46-35(55-38)11-7-6-10-31-32(59-46)12-8-14-34-33(54-31)13-9-15-43-49(5,61-34)24-42-37(56-43)20-41-47(60-42)30(51)19-29(53-41)16-27(2)25-50/h6-8,14,25-26,28-44,46-47,51H,2,9-13,15-24H2,1,3-5H3/b7-6-,14-8-/t26-,28+,29-,30+,31-,32+,33+,34-,35+,36+,37+,38-,39-,40+,41-,42-,43-,44+,46-,47+,48-,49+/m1/s1
- Alternative InChis
- Spectra available
- Unknown
- Chem files
- Certified
- Unknown
- Certified links
-
-
n/a
- Non certified reference material
- Unknown
Chemical analysis
- Research
- Unknown
- 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
- Regulatory status
- Unknown
- Human toxic syndrome(s)
- n/a
- Organ system toxicity
- n/a
- Risk assessment
- Unknown
- Molecular targets known
- Unknown
- Molecular targets
- n/a
- Toxic to aquatic animals
- Unknown
- TEF available
- Unknown
- Notes
- Christopher Miles
- Contact