Record Information |
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Version | 2.0 |
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Creation Date | 2012-10-10 12:14:04 -0600 |
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Update Date | 2015-08-05 16:22:03 -0600 |
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Secondary Accession Numbers | |
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Identification |
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Name: | (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate |
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Description | Trianion of (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate arising from deprotonation of the three diphosphate OH groups |
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Structure | |
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Synonyms: | - (2-amino-4-Hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate trianion
- (2-amino-4-Hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate(3-)
- (2-amino-4-Hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphoric acid
- (2-amino-4-Hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphoric acid trianion
- (2-amino-4-Hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphoric acid(3-)
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Chemical Formula: | C7H8N5O8P2 |
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Weight: | Average: 352.1146 Monoisotopic: 351.984810281 |
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InChI Key: | FCQGJGLSOWZZON-UHFFFAOYSA-K |
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InChI: | InChI=1S/C7H11N5O8P2/c8-7-11-5-4(6(13)12-7)10-3(1-9-5)2-19-22(17,18)20-21(14,15)16/h1-2H2,(H,17,18)(H2,14,15,16)(H4,8,9,11,12,13)/p-3 |
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CAS number: | Not Available |
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IUPAC Name: | 6-({[hydroxy(phosphonooxy)phosphoryl]oxy}methyl)-2-imino-1,2,7,8-tetrahydropteridin-4-olate |
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Traditional IUPAC Name: | 6-({[hydroxy(phosphonooxy)phosphoryl]oxy}methyl)-2-imino-7,8-dihydro-1H-pteridin-4-olate |
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SMILES: | OP(=O)(OCC1=NC2=C(NC1)NC(=N)N=C2[O-])OP([O-])([O-])=O |
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Chemical Taxonomy |
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Description | belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one. |
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Kingdom | Organic compounds |
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Super Class | Organoheterocyclic compounds |
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Class | Pteridines and derivatives |
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Sub Class | Pterins and derivatives |
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Direct Parent | Pterins and derivatives |
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Alternative Parents | |
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Substituents | - Pterin
- Organic pyrophosphate
- Aminopyrimidine
- Pyrimidone
- Secondary aliphatic/aromatic amine
- Organic phosphoric acid derivative
- Alkyl phosphate
- Phosphoric acid ester
- Pyrimidine
- Heteroaromatic compound
- Vinylogous amide
- Ketimine
- Azacycle
- Secondary amine
- Organic oxygen compound
- Primary amine
- Organic oxide
- Organooxygen compound
- Organonitrogen compound
- Organic nitrogen compound
- Organopnictogen compound
- Imine
- Hydrocarbon derivative
- Amine
- Organic anion
- Aromatic heteropolycyclic compound
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Molecular Framework | Aromatic heteropolycyclic compounds |
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External Descriptors | |
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Physical Properties |
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State: | Not Available |
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Charge: | -2 |
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Melting point: | Not Available |
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Experimental Properties: | |
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Predicted Properties | |
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Biological Properties |
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Cellular Locations: | Cytoplasm |
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Reactions: | |
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SMPDB Pathways: | |
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KEGG Pathways: | |
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EcoCyc Pathways: | Not Available |
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Concentrations |
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| Not Available |
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Spectra |
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Spectra: | |
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References |
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References: | Not Available |
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Synthesis Reference: | Not Available |
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Material Safety Data Sheet (MSDS) | Not Available |
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Links |
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External Links: | Resource | Link |
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CHEBI ID | 57602 | HMDB ID | HMDB0304228 | Pubchem Compound ID | Not Available | Kegg ID | Not Available | ChemSpider ID | 24784870 | Wikipedia ID | Not Available | BioCyc ID | Not Available |
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