| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-07-13 19:54:35 UTC |
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| Update Date | 2016-07-20 21:02:23 UTC |
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| Lmdb | LMDB00647 |
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| Secondary Accession Numbers | None |
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| Metabolite Identification |
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| Common Name | Fosfomycin |
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| Description | Fosfomycin, also known as phosphonomycin or FCM, belongs to the class of organic compounds known as organic phosphonic acids. These are organic compounds containing phosphonic acid. Fosfomycin has been detected, but not quantified in, milk (cow). This could make fosfomycin a potential biomarker for the consumption of these foods. Fosfomycin is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review a significant number of articles have been published on Fosfomycin. |
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| Structure | |
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| Synonyms | | Value | Source |
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| (-)-(1R,2S)-(1,2-Epoxypropyl)phosphonic acid | ChEBI | | (1R,2S)-Epoxypropylphosphonic acid | ChEBI | | (2R-cis)-(3-Methyloxiranyl)phosphonic acid | ChEBI | | 1R-cis-(1,2-Epoxypropyl)phosphonic acid | ChEBI | | cis-(1R,2S)-Epoxypropylphosphonic acid | ChEBI | | FCM | ChEBI | | Fosfomicina | ChEBI | | Fosfomycine | ChEBI | | Fosfomycinum | ChEBI | | L-cis-1,2-Epoxypropylphosphonic acid | ChEBI | | Phosphomycin | ChEBI | | Phosphonemycin | ChEBI | | Phosphonomycin | ChEBI | | (1R,2S)-Epoxypropylphosphonate | Kegg | | (-)-(1R,2S)-(1,2-Epoxypropyl)phosphonate | Generator | | (2R-cis)-(3-Methyloxiranyl)phosphonate | Generator | | 1R-cis-(1,2-Epoxypropyl)phosphonate | Generator | | cis-(1R,2S)-Epoxypropylphosphonate | Generator | | L-cis-1,2-Epoxypropylphosphonate | Generator | | Fosfocina | HMDB | | Fosfomycin disodium salt | HMDB | | Fosfomycin sodium | HMDB | | Fosfonomycin | HMDB | | Phosphomycin disodium salt | HMDB | | Fosfomycin tromethamine | HMDB | | Fosfomycin trometamol salt | HMDB | | Tromethamine, fosfomycin | HMDB | | Monuril | HMDB |
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| Chemical Formula | C3H7O4P |
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| Average Molecular Weight | 138.059 |
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| Monoisotopic Molecular Weight | 138.008195224 |
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| IUPAC Name | [(2R,3S)-3-methyloxiran-2-yl]phosphonic acid |
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| Traditional Name | fosfomycin |
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| CAS Registry Number | 23155-02-4 |
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| SMILES | C[C@@H]1O[C@@H]1P(O)(O)=O |
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| InChI Identifier | InChI=1S/C3H7O4P/c1-2-3(7-2)8(4,5)6/h2-3H,1H3,(H2,4,5,6)/t2-,3+/m0/s1 |
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| InChI Key | YMDXZJFXQJVXBF-STHAYSLISA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as organic phosphonic acids. These are organic compounds containing phosphonic acid. |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Organic phosphonic acids and derivatives |
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| Sub Class | Organic phosphonic acids |
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| Direct Parent | Organic phosphonic acids |
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| Alternative Parents | |
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| Substituents | - Organophosphonic acid
- Oxacycle
- Organoheterocyclic compound
- Oxirane
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Organophosphorus compound
- Organooxygen compound
- Aliphatic heteromonocyclic compound
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| Molecular Framework | Aliphatic heteromonocyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Detected but not Quantified |
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| Origin | Not Available |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | Not Available |
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| Physical Properties |
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| State | Not Available |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | | Spectrum Type | Description | Splash Key | View |
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| GC-MS | GC-MS Spectrum - GC-MS (2 TMS) | splash10-03di-2980000000-005d5b96a1e9219362d0 | Spectrum | | GC-MS | GC-MS Spectrum - GC-MS (Non-derivatized) | splash10-03di-2980000000-005d5b96a1e9219362d0 | Spectrum | | Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive | splash10-003r-9100000000-f3dc2512a6ad53fb9238 | Spectrum | | Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive | Not Available | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-000i-1900000000-3025442157ee47184674 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-001i-9100000000-275a01dd7f8cc74a7b6f | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-001i-9100000000-859fa61894a0825e23d2 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-000i-3900000000-22234a977a4d3da18ecf | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-05qi-9500000000-81b95429a7694bba36c7 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-057i-9000000000-d2dbdb85a43ce508ab14 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-000i-2900000000-3865d3126791b7f8f8f3 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-000b-9400000000-d43f705d0ad2bb7e25c9 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-06tn-9000000000-5460c55de4fe7bea9b0d | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-03dr-9400000000-f59b9b60406eacd3c3da | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-03fr-9000000000-eb71c23b854ab0f65f4a | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-03di-9000000000-987956f210941d36e458 | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum |
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