| CAS Number | 9072-19-9 |
| Catalog Number | AG00GR9P(AGN-PC-0VR1PX) |
| Chemical Name | Fucoidan |
| IUPAC Name | [(2S,3S,4S,5S,6R)-4,5-dihydroxy-2,6-dimethyloxan-3-yl] hydrogen sulfate |
| InChI | InChI=1S/C7H14O7S/c1-3-5(8)6(9)7(4(2)13-3)14-15(10,11)12/h3-9H,1-2H3,(H,10,11,12)/t3-,4+,5-,6+,7-/m1/s1 |
| InChI Key | NLMDZXKCTWKRSQ-IBISWUOJSA-N |
| MDL Number | MFCD00131109 |
| Molecular Formula | C8H16O7S |
| Molecular Weight | 256.2734 |
| SMILES | C[C@H]([C@H]([C@@H]1O)OC)O[C@@H](C)[C@H]1OS(O)(=O)=O |
| Synonyms | fucan sulfate,
fucan sulfate Hor-1,
fucoidan,
fucoidin,
meFucoidan,
Mekabu fucoidan,
sulfated fucans,
Fucoidan,
9072-19-9,
ZINC97974745,
SC-16162,
FT-0688792,
meFucoidan,
Fucoidin,
Mekabu fucoidan,
Sulfated fucans,
Fucan sulfate,
fucan sulfate Hor-1,
C007789,
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| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 5 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.046024g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.25g/mol |
| Monoisotopic Mass | 242.046024g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 122Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number