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CNU : Summary
Code ![](/pdbe/static/images/help.png)
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CNU
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One-letter code ![](/pdbe/static/images/help.png)
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U
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Molecule name ![](/pdbe/static/images/help.png)
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5-CYANO-URIDINE-5'-MONOPHOSPHATE
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Synonyms ![](/pdbe/static/images/help.png)
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5-cyano-UMP
5-cyanouridine 5'-(dihydrogen phosphate)
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Systematic names ![](/pdbe/static/images/help.png)
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Formula ![](/pdbe/static/images/help.png)
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C10 H12 N3 O9 P
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Formal charge ![](/pdbe/static/images/help.png)
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0
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Molecular weight ![](/pdbe/static/images/help.png)
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349.191 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
10.04 |
N#CC=1C(=O)NC(=O)N(C=1)C2OC(C(O)C2O)COP(=O)(O)O |
SMILES
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CACTVS |
3.341 |
O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)N2C=C(C#N)C(=O)NC2=O |
SMILES
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OpenEye OEToolkits |
1.5.0 |
C1=C(C(=O)NC(=O)N1C2C(C(C(O2)COP(=O)(O)O)O)O)C#N |
Canonical SMILES
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CACTVS |
3.341 |
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)N2C=C(C#N)C(=O)NC2=O |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)C#N |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C10H12N3O9P/c11-1-4-2-13(10(17)12-8(4)16)9-7(15)6(14)5(22-9)3-21-23(18,19)20/h2,5-7,9,14-15H,3H2,(H,12,16,17)(H2,18,19,20)/t5-,6-,7-,9-/m1/s1 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | BUHKUGLYORHFNN-JXOAFFINSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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35 (23 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Ribonucleotide
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Type description ![](/pdbe/static/images/help.png)
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RNA linking
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Type code ![](/pdbe/static/images/help.png)
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ATOMN
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Is modified ![](/pdbe/static/images/help.png)
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Yes
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Standard parent ![](/pdbe/static/images/help.png)
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U
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Defined at ![](/pdbe/static/images/help.png)
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2007-12-14
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Last modified at ![](/pdbe/static/images/help.png)
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2020-06-17
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Status ![](/pdbe/static/images/help.png)
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Released
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Obsoleted ![](/pdbe/static/images/help.png)
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Not Assigned
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