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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB120135 |
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Identification |
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| Name: |
preQ1 |
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| Description: | Conjugate acid of 7-aminomethyl-7-deazaguanine. |
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Structure |
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| Synonyms: | - 7-aminomethyl-7-deazaguanine7-aminomethyl-7-carbaguanine
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Chemical Formula: |
C7H10N5O |
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| Average Molecular Weight: |
180.189 |
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| Monoisotopic Molecular
Weight: |
180.08853 |
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| InChI Key: |
MEYMBLGOKYDGLZ-UHFFFAOYSA-O |
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| InChI: | InChI=1S/C7H9N5O/c8-1-3-2-10-5-4(3)6(13)12-7(9)11-5/h2H,1,8H2,(H4,9,10,11,12,13)/p+1 |
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| CAS
number: |
Not Available |
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| IUPAC Name: | (2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methanaminium |
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Traditional IUPAC Name: |
Not Available |
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| SMILES: | C([N+])C2(C1(C(=O)NC(N)=NC=1NC=2)) |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions. |
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Kingdom |
Organic compounds |
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| Super Class | Organoheterocyclic compounds |
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Class |
Pyrrolopyrimidines |
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| Sub Class | Pyrrolo[2,3-d]pyrimidines |
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Direct Parent |
Pyrrolo[2,3-d]pyrimidines |
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| Alternative Parents |
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| Substituents |
Not Available |
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| Molecular Framework |
Aromatic heteropolycyclic compounds |
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| External Descriptors |
Not Available |
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Physical Properties |
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| State: |
Not Available |
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| Charge: | 1 |
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Melting point: |
Not Available |
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| Experimental Properties: |
Not Available |
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| Predicted Properties |
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Biological Properties |
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| Cellular Locations: |
Not Available |
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| Reactions: | |
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Pathways: |
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Spectra |
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| Spectra: |
Not Available |
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References |
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| References: |
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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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