12-Methylgymnodimine-A

Gymnodimine

Last updated at: Oct. 25, 2023

Recommended name
12-Methylgymnodimine-A
Synonyms
12-methylgymnodimine A, 12-Methylgymnodimine A
Recommended acronym
12-MeGYM-A
Abbreviation

Progenitors

Name
Alexandrium ostenfeldii
Note
Van Wagoner et al., 2011

Vector Species

No vector species registered

References

Ryan M. Van Wagoner, 2011
Van Wagoner, R. M., Misner, I., Tomas, C. R., & Wright, J. L. (2011). Occurrence of 12-methylgymnodimine in a spirolide-producing dinoflagellate Alexandrium peruvianum and the biogenetic implications. Tetrahedron Letters, 52(33), 4243-4246.
Dedmer B. Van de Waal, 2015
Van de Waal, D. B., Tillmann, U., Martens, H., Krock, B., van Scheppingen, Y., & John, U. (2015). Characterization of multiple isolates from an Alexandrium ostenfeldii bloom in The Netherlands. Harmful Algae, 49, 94-104.
Structure
Formula
C33H47NO4
Exact mono-isotopic mass
521.35051
Molfile
n/a
Alternative molfiles
n/a
SMILES
N1=C2[C@]3(CCC1)[C@H](C(=C(CC3)C1C=C(C(=O)O1)C)C)/C=C(\C)/[C@H](C[C@H](C1C[C@H](C(/C(=C/CC2)/C)O1)C)C)O
Alternative SMILES
N1(=C4(C2(CCC1)(C(C(=C(CC2)C3(C=C(C(=O)O3)C))C)C=C(C)C(CC(C5(CC(C(C(=CCC4)C)O5)C))C)O)))
InChi key
IFJZMBMXBYAZGF-AGUKPVBSSA-N
Alternative InChi keys
n/a
InChi
InChI=1S/C33H47NO4/c1-19-9-7-10-30-33(12-8-14-34-30)13-11-25(29-18-23(5)32(36)38-29)24(6)26(33)15-20(2)27(35)16-21(3)28-17-22(4)31(19)37-28/h9,15,18,21-22,26-29,31,35H,7-8,10-14,16-17H2,1-6H3/b19-9+,20-15+/t21-,22-,26+,27+,28?,29?,31?,33+/m1/s1
Alternative InChis
Spectra available
Unknown
Chem files

References

Ryan M. Van Wagoner, None
Van Wagoner, R. M., Misner, I., Tomas, C. R., & Wright, J. L. (2011). Occurrence of 12-methylgymnodimine in a spirolide-producing dinoflagellate Alexandrium peruvianum and the biogenetic implications. Tetrahedron Letters, 52(33), 4243-4246.
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

References

Ryan M. Van Wagoner, None
Van Wagoner, R. M., Misner, I., Tomas, C. R., & Wright, J. L. (2011). Occurrence of 12-methylgymnodimine in a spirolide-producing dinoflagellate Alexandrium peruvianum and the biogenetic implications. Tetrahedron Letters, 52(33), 4243-4246.
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
Aifeng Li
Contact
Christopher Miles
Contact