| CAS Number | 70622-74-1 |
| Product Name | Mnp-glcnac |
| IUPAC Name | N-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxy-5-[(E)-2-nitroethenyl]-2-phenoxyoxan-3-yl]acetamide |
| Molecular Formula | C17H22N2O9 |
| Molecular Weight | 398.4 g/mol |
| InChI | InChI=1S/C17H22N2O9/c1-11(21)18-17(26-2)14(22)16(23,8-9-19(24)25)13(10-20)28-15(17)27-12-6-4-3-5-7-12/h3-9,13-15,20,22-23H,10H2,1-2H3,(H,18,21)/b9-8+/t13-,14+,15-,16-,17+/m1/s1 |
| InChI Key | YHWRKXMTISIYOF-GVVSDTBTSA-N |
| SMILES | CC(=O)NC1(C(C(C(OC1OC2=CC=CC=C2)CO)(C=C[N+](=O)[O-])O)O)OC |
| Synonyms | 2-methoxy-4-(2′-nitrovinyl)phenyl-2-acetamido-2-deoxy-beta-glucopyranoside, MNP-GlcNAc |
| Canonical SMILES | CC(=O)NC1(C(C(C(OC1OC2=CC=CC=C2)CO)(C=C[N+](=O)[O-])O)O)OC |
| Isomeric SMILES | CC(=O)N[C@@]1([C@H]([C@]([C@H](O[C@H]1OC2=CC=CC=C2)CO)(/C=C/[N+](=O)[O-])O)O)OC |
COA:
Name: 2-Methoxy-4-(2′-nitrovinyl)phenyl-2-acetamido-2-deoxy-beta-glucopyranoside
CAS: 70622-74-1 M.F.: C17H22N2O9 M.W.: 398.4
Items | Standards | Results |
Appearance | Crystal powder | Complies |
Solubility | Soluble inDMSO and DMF, insoluble C2H5OH | Complies |
Identification | IR and HPLC | Complies |
Melting point | 180? ~ 200 ?C | 190? ~200 ? |
Specific rotation ( [?]D, c =1 inDMSO) | -8o ~ -9o | -8.5o |
Total impurity | Max. 2% | Complies |
Heavy metal | Max. 20ppm | Complies |
Residue on ignition | Max. 0.5% | 0.1% |
TLC | One spot | One spot |
Assay by HPLC | Min. 98% | 98.2% |
| Size | 1 G, 100 MG, 5 G, Other |
|---|
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