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MSE : Summary
Code 
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MSE
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One-letter code 
|
M
|
Molecule name 
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SELENOMETHIONINE
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Systematic names 
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Formula 
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C5 H11 N O2 Se
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Formal charge 
|
0
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Molecular weight 
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196.106 Da
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SMILES 
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Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)C(N)CC[Se]C |
SMILES
|
CACTVS |
3.341 |
C[Se]CC[CH](N)C(O)=O |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
C[Se]CCC(C(=O)O)N |
Canonical SMILES
|
CACTVS |
3.341 |
C[Se]CC[C@H](N)C(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
C[Se]CC[C@@H](C(=O)O)N |
|
IUPAC InChI  | InChI=1S/C5H11NO2Se/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1 |
IUPAC InChI key  | RJFAYQIBOAGBLC-BYPYZUCNSA-N |
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wwPDB Information |
Atom count 
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20 (9 without Hydrogen)
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Polymer type 
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Amino Acid
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Type description 
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L-PEPTIDE LINKING
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Type code 
|
ATOMP
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Is modified 
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Yes
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Standard parent 
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MET
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Defined at 
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1999-07-08
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Last modified at 
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2011-06-04
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Status 
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Released
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Obsoleted 
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Not Assigned
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