- Recommended name
- Pectenotoxin-3
- Synonyms
- n/a
- Recommended acronym
- PTX3
- Abbreviation
Progenitors
No progenitors registered
Vector Species
No vector species registered
- Structure
-
- Formula
- C47H68O15
- Exact mono-isotopic mass
- 872.4558
- Molfile
- n/a
- Alternative molfiles
- n/a
- SMILES
- CC(/C=C/[C@@H]1[C@H](O2)C[C@@H]([C@]3(O)[C@H](O)[C@H](C)CCO3)O1)=C\[C@H](C)C[C@@]4(C)CC[C@H]([C@@]5(CC6)O[C@@H]([C@H]7O[C@]([C@@H](O)[C@H]8O[C@@]9(O[C@H]([C@@H](C)C2=O)CCC9)CC8)(C)CC7=O)C[C@]6(O5)C=O)O4
- Alternative SMILES
- n/a
- InChi key
- BFHAYPLBUQVNNJ-VWTMXFPPSA-N
- Alternative InChi keys
- n/a
- InChi
- InChI=1S/C47H68O15/c1-26-9-10-32-34(21-37(55-32)47(53)39(50)28(3)13-19-54-47)56-41(52)29(4)31-8-7-14-45(57-31)16-11-33(58-45)40(51)43(6)23-30(49)38(61-43)35-24-44(25-48)17-18-46(59-35,62-44)36-12-15-42(5,60-36)22-27(2)20-26/h9-10,20,25,27-29,31-40,50-51,53H,7-8,11-19,21-24H2,1-6H3/b10-9+,26-20+/t27-,28+,29+,31-,32+,33-,34+,35+,36+,37-,38-,39+,40-,42+,43+,44-,45+,46-,47+/m0/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