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AME : Summary
Code ![](/pdbe/static/images/help.png)
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AME
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One-letter code ![](/pdbe/static/images/help.png)
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M
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Molecule name ![](/pdbe/static/images/help.png)
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N-ACETYLMETHIONINE
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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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C7 H13 N O3 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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191.248 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 |
O=C(NC(C(=O)O)CCSC)C |
SMILES
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CACTVS |
3.341 |
CSCC[CH](NC(C)=O)C(O)=O |
SMILES
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OpenEye OEToolkits |
1.5.0 |
CC(=O)NC(CCSC)C(=O)O |
Canonical SMILES
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CACTVS |
3.341 |
CSCC[C@H](NC(C)=O)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
CC(=O)N[C@@H](CCSC)C(=O)O |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C7H13NO3S/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | XUYPXLNMDZIRQH-LURJTMIESA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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25 (12 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Bound ligand
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Type description ![](/pdbe/static/images/help.png)
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L-peptide NH3 amino terminus
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Type code ![](/pdbe/static/images/help.png)
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HETAIN
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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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MET
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Defined at ![](/pdbe/static/images/help.png)
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2000-05-11
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Last modified at ![](/pdbe/static/images/help.png)
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2020-07-15
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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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