| CAS Number | 136132-69-9 |
| Catalog Number | AG009C1I(AGN-PC-00URHQ) |
| Chemical Name | Chondroitin disaccharide Deltadi-0S sodium salt |
| IUPAC Name | 2-(2-acetamido-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid;sodium |
| InChI | InChI=1S/C14H21NO11.Na/c1-5(18)15-6(3-16)12(10(21)8(20)4-17)26-14-11(22)7(19)2-9(25-14)13(23)24;/h2-3,6-8,10-12,14,17,19-22H,4H2,1H3,(H,15,18)(H,23,24); |
| InChI Key | ZIEOMBVLIDBWRW-UHFFFAOYSA-N |
| MDL Number | MFCD00133173 |
| Molecular Formula | C14H20NNaO11 |
| Molecular Weight | 401.2985 |
| SMILES | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](OC1O)CO)O)OC2[C@@H]([C@H](C=C(O2)C(=O)[O-])O)O.[Na+] |
| Synonyms | 136132-69-9,
149368-06-9,
Chondroitin disaccharide di-0S sodium salt,
Chondroitin disaccharide Deltadi-0S sodium salt,
Chondroitin disaccharide | currencydi-0S sodium salt,
Hyaluronic acid disaccharide | currencyDiHA sodium salt,
Hyaluronic acid disaccharide DeltaDiHA sodium salt, >=85%,
UNII-49736XM60I,
Chondroitin disaccharide deltadi-0S monosodium,
|A-| currencyUA-(1 inverted exclamation marku3)-GlcNAc,
|A-| currencyUA-[1 inverted exclamation marku3]-GalNAc,
D-Galactose, 2-(acetylamino)-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl)-, monosodium salt,
|
| Complexity | 551 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 402.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 11 |
| Hydrogen Bond Donor Count | 7 |
| Isotope Atom Count | 0 |
| Molecular Weight | 402.308g/mol |
| Monoisotopic Mass | 402.101g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 203A^2 |
| Undefined Atom Stereocenter Count | 7 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number