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QXV : Summary
Code ![](/pdbe/static/images/help.png)
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QXV
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One-letter code ![](/pdbe/static/images/help.png)
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X
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Molecule name ![](/pdbe/static/images/help.png)
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D-methioninamide
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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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C5 H12 N2 O S
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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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148.227 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 |
12.01 |
NC(C(N)=O)CCSC |
SMILES
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CACTVS |
3.385 |
CSCC[CH](N)C(N)=O |
SMILES
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OpenEye OEToolkits |
2.0.7 |
CSCCC(C(=O)N)N |
Canonical SMILES
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CACTVS |
3.385 |
CSCC[C@@H](N)C(N)=O |
Canonical SMILES
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OpenEye OEToolkits |
2.0.7 |
CSCC[C@H](C(=O)N)N |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C5H12N2OS/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H2,7,8)/t4-/m1/s1 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | GSYTVXOARWSQSV-SCSAIBSYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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21 (9 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Amino Acid
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Type description ![](/pdbe/static/images/help.png)
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D-peptide linking
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Type code ![](/pdbe/static/images/help.png)
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ATOMP
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Is modified ![](/pdbe/static/images/help.png)
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No
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Standard parent ![](/pdbe/static/images/help.png)
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Not Assigned
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Defined at ![](/pdbe/static/images/help.png)
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2020-01-13
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Last modified at ![](/pdbe/static/images/help.png)
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2020-02-21
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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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