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6DN : Summary
Code
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6DN
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One-letter code
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K
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Molecule name
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(2~{S})-2-azanyl-6-(2-hydroxy-2-oxoethylamino)hexanoic acid
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Systematic names
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Formula
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C8 H16 N2 O4
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Formal charge
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0
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Molecular weight
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204.224 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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CACTVS |
3.385 |
N[CH](CCCCNCC(O)=O)C(O)=O |
SMILES
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OpenEye OEToolkits |
2.0.5 |
C(CCNCC(=O)O)CC(C(=O)O)N |
Canonical SMILES
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CACTVS |
3.385 |
N[C@@H](CCCCNCC(O)=O)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
2.0.5 |
C(CCNCC(=O)O)C[C@@H](C(=O)O)N |
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IUPAC InChI | InChI=1S/C8H16N2O4/c9-6(8(13)14)3-1-2-4-10-5-7(11)12/h6,10H,1-5,9H2,(H,11,12)(H,13,14)/t6-/m0/s1 |
IUPAC InChI key | NUXSIDPKKIEIMI-LURJTMIESA-N |
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wwPDB Information |
Atom count
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30 (14 without Hydrogen)
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Polymer type
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Amino Acid
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Type description
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NON-POLYMER
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Type code
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ATOMP
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Is modified
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Yes
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Standard parent
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LYS
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Defined at
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2016-03-30
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Last modified at
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2023-11-03
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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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