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CHEMISTRY
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ACTIVE PHARMA INGREDIENTS

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Synopsis

ACTIVE PHARMA INGREDIENTS

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Chemistry

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Also known as: 6-deoxy-galactopyranose, 6-deoxy-galactopyranoside, 6-deoxy-galactose, 6-deoxy-l-galactopyranose, 6-deoxy-l-galactopyranoside, 6-deoxy-l-galactose

Molecular Formula

C₆H₁₂O₅

Molecular Weight

164.16 g/mol

InChI Key

SHZGCJCMOBCMKK-DHVFOXMCSA-N

Fucose is a metabolite found in the aging mouse brain.

1 2D Structure

L-Fucose

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol

2.1.2 InChI

InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m0/s1

2.1.3 InChI Key

SHZGCJCMOBCMKK-DHVFOXMCSA-N

2.1.4 Canonical SMILES

CC1C(C(C(C(O1)O)O)O)O

2.1.5 Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@@H](C(O1)O)O)O)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 6-deoxy-galactopyranose

2. 6-deoxy-galactopyranoside

3. 6-deoxy-galactose

4. 6-deoxy-l-galactopyranose

5. 6-deoxy-l-galactopyranoside

6. 6-deoxy-l-galactose

7. Fuc

8. Fucose

9. L-fuc

10. L-fucopyranose

11. 87-96-7

12. L-galactomethylose

13. (3s,4r,5s,6s)-6-methyltetrahydro-2h-pyran-2,3,4,5-tetraol

14. Chebi:2181

15. (-)-fucose

16. Chembl469449

17. 6-desoxygalactose

18. (3s,4r,5s,6s)-6-methyloxane-2,3,4,5-tetrol

19. (-)-l-fucose

20. 6-deoxy-l-beta-galactose

21. Fucopyranose

22. L-galactopyranose, 6-deoxy-

23. Nsc-1219

24. 6-methyltetrahydropyran-2,3,4,5-tetraol

25. Bmse000036

26. Epitope Id:152214

27. Fucopyranose, L- (7ci)

28. Schembl63943

29. Dtxsid501016770

30. Bdbm50242419

31. L-galactopyranose, 6-deoxy- (9ci)

32. 6-deoxy-l-galactopyranosel-fucopyranose

33. C01019

34. Q409082

35. O_full_00100000000000_gs_657

36. Wurcs=2.0/1,1,0/[a1221m-1x_1-5]/1/

2.3 Create Date

2005-06-01

3 Chemical and Physical Properties

Molecular Formula	C₆H₁₂O₅
Molecular Weight	164.16 g/mol
XLogP3	-2.1
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	164.06847348 g/mol
Monoisotopic Mass	164.06847348 g/mol
Topological Polar Surface Area	90.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	139
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1