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Also known as: 845959-50-4, Mitoq, Mitoquinone methanesulfonate, 6e01cg547t, Phosphonium, (10-(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)decyl)triphenyl-, methanesulfonate (1:1), Dtxsid00233573

Molecular Formula

C₃₈H₄₇O₇PS

Molecular Weight

678.8 g/mol

InChI Key

GVZFUVXPTPGOQT-UHFFFAOYSA-M

FDA UNII

6E01CG547T

MITOQUINONE MESYLATE is a small molecule drug with a maximum clinical trial phase of II (across all indications) and has 5 investigational indications.

1 2D Structure

Mitoquinone mesylate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

10-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)decyl-triphenylphosphanium;methanesulfonate

2.1.2 InChI

InChI=1S/C37H44O4P.CH4O3S/c1-29-33(35(39)37(41-3)36(40-2)34(29)38)27-19-8-6-4-5-7-9-20-28-42(30-21-13-10-14-22-30,31-23-15-11-16-24-31)32-25-17-12-18-26-32;1-5(2,3)4/h10-18,21-26H,4-9,19-20,27-28H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1

2.1.3 InChI Key

GVZFUVXPTPGOQT-UHFFFAOYSA-M

2.2 Other Identifiers

2.2.1 UNII

6E01CG547T

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Mitoq

2. Mito-q

3. Mitoquinone Methanesulfonate

4. Phosphonium, (10-(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)decyl)triphenyl-, Methanesulfonate (1:1)

2.3.2 Depositor-Supplied Synonyms

1. 845959-50-4

2. Mitoq

3. Mitoquinone Methanesulfonate

4. 6e01cg547t

5. Phosphonium, (10-(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)decyl)triphenyl-, Methanesulfonate (1:1)

6. Dtxsid00233573

7. Refchem:159104

8. Dtxcid30156064

9. Unii-6e01cg547t

10. Mitoquinone (mesylate)

11. 10-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)decyl-triphenylphosphanium;methanesulfonate

12. Mitoq10 Mesylate

13. Mitoquinone Mesilate

14. Mitoubiquinone Mesylate

15. C38h47o7ps

16. Orb1992776

17. Schembl4423673

18. Chembl4074884

19. Mitoquinone (mitoq10) Mesylate

20. Chebi:234429

21. Hms6019o05

22. Ex-a1985

23. Mitoquinone Mesilate [who-dd]

24. Akos040733750

25. Cs-7565

26. Hy-100116a

27. Da-75568

28. Fm157162

29. G16037

30. Q15425822

31. (10-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)decyl)triphenylphosphonium Methanesulfonate

32. 10-(4,5-dimethoxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)decyl-triphenyl-phosphonium;methanesulfonate

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₃₈H₄₇O₇PS
Molecular Weight	678.8 g/mol
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	16
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	118
Heavy Atom Count	47
Formal Charge	0
Complexity	965
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2