Record Information |
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Version |
1.0 |
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Update Date |
1/22/2018 11:54:54 AM |
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Metabolite ID | PAMDB001591 |
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Identification |
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Name: |
6-Hydroxymethyl-dihydropterin pyrophosphate |
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Description: | 6-hydroxymethyl-dihydropterin pyrophosphate is a member of the chemical class known as Pterins and Derivatives. These are polycyclic aromatic compounds containing a pterin moeity, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one. |
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Structure |
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Synonyms: | - (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate
- (2-amino-4-Hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphoric acid
- 2-Amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)-pteridine
- 6-hydroxymethyl-dihydropterin pyrophosphate
- 6-Hydroxymethyl-dihydropterin pyrophosphoric acid
- AHHMeDHPDP
- Dihydropterin-CH2OH-diphosphate
- Dihydropterin-CH2OH-diphosphoric acid
- Dihydropterin-CH2OH-pp
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Chemical Formula: |
C7H8N5O8P2 |
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Average Molecular Weight: |
352.1146 |
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Monoisotopic Molecular
Weight: |
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(phosphonatooxy)phosphoryl]oxy}methyl)-2-imino-1,2,7,8-tetrahydropteridin-4-olate |
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Traditional IUPAC Name: |
6-({[hydroxy(phosphonatooxy)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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Taxonomy Description | This compound 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
- Hydroxypyrimidine
- Secondary aliphatic/aromatic amine
- Imidolactam
- Alkyl phosphate
- Pyrimidine
- Primary aromatic amine
- Phosphoric acid ester
- Organic phosphoric acid derivative
- Organic phosphate
- Heteroaromatic compound
- Ketimine
- Azacycle
- Secondary amine
- Hydrocarbon derivative
- Primary amine
- Organooxygen compound
- Organonitrogen compound
- Imine
- 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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Pathways: |
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Spectra |
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Spectra: |
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References |
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References: |
- Keseler, I. M., Collado-Vides, J., Santos-Zavaleta, A., Peralta-Gil, M., Gama-Castro, S., Muniz-Rascado, L., Bonavides-Martinez, C., Paley, S., Krummenacker, M., Altman, T., Kaipa, P., Spaulding, A., Pacheco, J., Latendresse, M., Fulcher, C., Sarker, M., Shearer, A. G., Mackie, A., Paulsen, I., Gunsalus, R. P., Karp, P. D. (2011). "EcoCyc: a comprehensive database of Escherichia coli biology." Nucleic Acids Res 39:D583-D590. Pubmed: 21097882
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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: |
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