| Description |
Nafcillin-[d5] sodium salt is the labelled salt of Nafcillin. Nafcillin, a semi-synthetic β-lactamase-resistant penicillin analogue, has been found to be an antibiotic that could be effective especially against Gram-positive bacteria. |
| Synonyms |
Nafcillin-D5 sodium salt; (2S,5R,6R)-6-[[(2-(Ethoxy-d5)-1-naphthalenyl)carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid Sodium Salt; Naftopen-d5; Naphthicillin-d5; Nafcil-d5; Sodium 6-(2-(ethoxy-d5)-1-naphthamido)penicillanate; 6-(2-(Ethoxy-d5)-1-naphthamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid Sodium Salt; 6-(2-(Ethoxy-d5)-1-naphthamido)penicillin Sodium Salt; Sodium Nafcillin-d5 |
| IUPAC Name |
sodium;(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-(1,1,2,2,2-pentadeuterioethoxy)naphthalene-1-carbonyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
| Related CAS |
985-16-0 (unlabelled) 147-52-4 (unlabelled free acid) |
| Canonical SMILES |
CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)[O-].[Na+] |
| InChI |
InChI=1S/C21H22N2O5S.Na/c1-4-28-13-10-9-11-7-5-6-8-12(11)14(13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23;/h5-10,15-16,19H,4H2,1-3H3,(H,22,24)(H,26,27);/q;+1/p-1/t15-,16+,19-;/m1./s1/i1D3,4D2; |
| InChI Key |
AYAPZOUDXCDGIF-LYVUTDJTSA-M |
| Melting Point |
157-160°C (dec.) |
| Purity |
≥97% by HPLC; ≥99% atom D |
| Solubility |
Soluble in DMSO (Slightly), Methanol (Slightly, Sonicated), Water (Slightly) |
| Appearance |
White to Pale Yellow Solid |
| Storage |
Store at -20°C under inert atmosphere |
![Nafcillin-[d5] sodium salt](https://resource.bocsci.com/structure/1356354-25-0.gif)
