Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0O2CM
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| Former ID |
DNC005137
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| Drug Name |
FLUORO-NEPLANOCIN A
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent | Investigative | [1] | ||
| Structure |
|
Download2D MOL |
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| Formula |
C11H12FN5O3
|
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| Canonical SMILES |
C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(=C3F)CO)O)O
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| InChI |
1S/C11H12FN5O3/c12-5-4(1-18)8(19)9(20)7(5)17-3-16-6-10(13)14-2-15-11(6)17/h2-3,7-9,18-20H,1H2,(H2,13,14,15)/t7-,8-,9+/m1/s1
|
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| InChIKey |
RWUXFWACUXDNKY-HLTSFMKQSA-N
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| PubChem Compound ID | |||||
| Target and Pathway | |||||
| Target(s) | Adenosylhomocysteinase | Target Info | Inhibitor | [1] | |
| BioCyc Pathway | Superpathway of methionine degradation | ||||
| Methionine degradation | |||||
| Cysteine biosynthesis | |||||
| KEGG Pathway | Cysteine and methionine metabolism | ||||
| Metabolic pathways | |||||
| PathWhiz Pathway | Selenoamino Acid Metabolism | ||||
| Betaine Metabolism | |||||
| Methionine Metabolism | |||||
| WikiPathways | Metabolism of amino acids and derivatives | ||||
| Trans-sulfuration and one carbon metabolism | |||||
| One Carbon Metabolism | |||||
| Trans-sulfuration pathway | |||||
| Phase II conjugation | |||||
| Folate Metabolism | |||||
| References | |||||
| REF 1 | Bioorg Med Chem Lett. 2004 Nov 15;14(22):5641-4.Synthesis of 5'-substituted fluoro-neplanocin A analogues: importance of a hydrogen bonding donor at 5'-position for the inhibitory activity of S-adenosylhomocysteine hydrolase. | ||||
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