![(6R,7S)-7-{2-[(cyanomethyl)thio]acetamido}-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)thio]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, sodium salt](/api/spectrum/6PZex9Ky80w/structure.png?h=300&w=458 "(6R,7S)-7-{2-[(cyanomethyl)thio]acetamido}-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)thio]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, sodium salt")
| SpectraBase Compound ID | ChKOX7rDV1L |
|---|---|
| InChI | InChI=1S/C15H17N7O5S3.Na/c1-21-14(18-19-20-21)30-6-8-5-29-13-15(27-2,17-9(23)7-28-4-3-16)12(26)22(13)10(8)11(24)25;/h13H,4-7H2,1-2H3,(H,17,23)(H,24,25);/q;+1/p-1/t13-,15+;/m1./s1 |
| InChIKey | BITQGIOJQWZUPL-PBCQUBLHSA-M |
| Mol Weight | 493.51 g/mol |
| Molecular Formula | C15H16N7NaO5S3 |
| Exact Mass | 493.027274 g/mol |
Ultraviolet-Visible (UV-Vis) Spectrum
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| SpectraBase Spectrum ID | 6PZex9Ky80w |
|---|---|
| Name | (6R,7S)-7-{2-[(cyanomethyl)thio]acetamido}-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)thio]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, sodium salt |
| Conditions | Acidic |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H16N7NaO5S3 |
| InChI | InChI=1S/C15H17N7O5S3.Na/c1-21-14(18-19-20-21)30-6-8-5-29-13-15(27-2,17-9(23)7-28-4-3-16)12(26)22(13)10(8)11(24)25;/h13H,4-7H2,1-2H3,(H,17,23)(H,24,25);/q;+1/p-1/t13-,15+;/m1./s1 |
| InChIKey | BITQGIOJQWZUPL-PBCQUBLHSA-M |
| Sadtler IR Number | 62160 |
| Sadtler UV Number | 34445A |
| Solvent | Methanol |