- Recommended name
- Pinnatoxin A
- Synonyms
- Pinnatoxin-A, (+)-pinnatoxin-A
- Recommended acronym
- PnTX-A
- Abbreviation
Progenitors
- Name
- Vulcanodinium rugosum
- Note
- Pinnatoxin A is not produced by Vulcanodinium rugosum (or other microalgae) but is a shellfish metabolite originally identified by Uemura et al., 1995, in Pinna muricata. For metabolism hypotheses see Selwood et al., 2010. PnTX-A likely derives from metabolism of PnTX-G, which in turn is produced by V. rugosum.
Vector Species
- Name
- Pinna muricata
- Note
- Pinnatoxin A is not produced by Vulcanodinium rugosum (or other microalgae) but is a shellfish metabolite originally identified by Uemura et al., 1995, in Pinna muricata. For metabolism hypotheses see Selwood et al., 2010. PnTX-A likely derives from metabolism of PnTX-G, which in turn is produced by V. rugosum.
References
- Uemura et al.,, 1995
- Uemura, D., Chou, T., Haino, T., Nagatsu, A., Fukuzawa, S., Zheng, S.-Z., Chen, H.-S., 1995. Pinnatoxin A: a toxic amphoteric macroycle from the Okinawan bivalve Pinna muricata. J. Am. Chem. Soc. 117, 1155-1156.
- Nézan & Chomérat,, 2011
- Nézan, E., Chomérat, N., 2011. Vulcanodinium rugosum gen. et sp. nov. (Dinophyceae), un nouveau dinoflagellé marin de la côte méditerraneenne française. Cryptogamie, Algologie 32(1), 3-18.
- Structure
-
- Formula
- C41H61NO9
- Exact mono-isotopic mass
- 711.434633
- Molfile
- see chemfiles
- Alternative molfiles
- n/a
- SMILES
- C[C@@H](CN=C1CCCC(C[C@@H]2CC[C@](O)(C)[C@](O2)(O3)CC[C@@]3(O4)CCC[C@@H]4C5)=C)[C@@H](C)C[C@@]61[C@]([C@@H]7O[C@]85C[C@@H](C)[C@@H](O)[C@H]7O8)([H])C=C(C(O)=O)CC6
- Alternative SMILES
- n/a
- InChi key
- ZYFHPTPXLHNGQK-OICTYLSBSA-N
- Alternative InChi keys
- n/a
- InChi
- InChI=1S/C41H61NO9/c1-24-8-6-10-32-38(20-25(2)27(4)23-42-32)15-11-28(36(44)45)19-31(38)34-35-33(43)26(3)21-40(49-34,50-35)22-30-9-7-13-39(47-30)16-17-41(51-39)37(5,46)14-12-29(18-24)48-41/h19,25-27,29-31,33-35,43,46H,1,6-18,20-23H2,2-5H3,(H,44,45)/t25-,26+,27-,29-,30+,31+,33+,34-,35+,37+,38+,39+,40+,41+/m0/s1
- Alternative InChis
- Spectra available
- True
- Chem files
- chemfiles/PnTX-A.cdxml chemfiles/PnTX-A.mol
References
- Selwood et al.,, 2010
- Selwood, A.I., Miles, C.O., Wilkins, A.L., van Ginkel, R., Munday, R., Rise, F., McNabb, P., 2010. Isolation, Structural Determination and Acute Toxicity of Pinnatoxins E, F and G. J. Agric. Food Chem. 58(10), 6532-6542.
- Araoz et al.,, 2011
- Araoz, R., Servent, D., Molgó, J., Iorga, B.I., Fruchart-Gaillard, C., Benoit, E., Gu, Z., Stivala, C.E., Zakarian, A., 2011. Total Synthesis of Pinnatoxins A and G and Revision of the Mode of Action of Pinnatoxin A. J. Am. Chem. Soc. 133(27), 10499-10511.
- Uemura et al.,, 1995
- Uemura, D., Chou, T., Haino, T., Nagatsu, A., Fukuzawa, S., Zheng, S.-Z., Chen, H.-S., 1995. Pinnatoxin A: a toxic amphoteric macroycle from the Okinawan bivalve Pinna muricata. J. Am. Chem. Soc. 117, 1155-1156.
- Certified
- Unknown
- Certified links
-
-
n/a
- Non certified reference material
- Unknown
Chemical analysis
- Research
- True
- Standardized
- False
- Validated
- False
- Official
- n/a
Structure recognition assays
- Research
- Unknown
- 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
- False
- Human toxic syndrome(s)
- n/a
- Organ system toxicity
- n/a
- Risk assessment
- True
- Molecular targets known
- True
- Molecular targets
- Nicotinic acetylcholine receptors
- Toxic to aquatic animals
- Unknown
- TEF available
- False
- Notes
- Pinnatoxin A is not produced by Vulcanodinium rugosum (or other microalgae) but is a shellfish metabolite originally identified by Uemura et al., 1995, in Pinna muricata. For metabolism hypotheses see Selwood et al., 2010. PnTX-A likely derives from metabolism of PnTX-G, which in turn is produced by V. rugosum.
References
- Uemura et al.,, 1995
- Uemura, D., Chou, T., Haino, T., Nagatsu, A., Fukuzawa, S., Zheng, S.-Z., Chen, H.-S., 1995. Pinnatoxin A: a toxic amphoteric macroycle from the Okinawan bivalve Pinna muricata. J. Am. Chem. Soc. 117, 1155-1156.
- Selwood et al.,, 2010
- Selwood, A.I., Miles, C.O., Wilkins, A.L., van Ginkel, R., Munday, R., Rise, F., McNabb, P., 2010. Isolation, Structural Determination and Acute Toxicity of Pinnatoxins E, F and G. J. Agric. Food Chem. 58(10), 6532-6542.
- Araoz et al.,, 2011
- Araoz, R., Servent, D., Molgó, J., Iorga, B.I., Fruchart-Gaillard, C., Benoit, E., Gu, Z., Stivala, C.E., Zakarian, A., 2011. Total Synthesis of Pinnatoxins A and G and Revision of the Mode of Action of Pinnatoxin A. J. Am. Chem. Soc. 133(27), 10499-10511.
- Philipp Hess
- Contact