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0EH : Summary
Code
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0EH
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One-letter code
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X
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Molecule name
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(2R)-2-amino-2-methylnonanoic acid
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Systematic names
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Formula
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C10 H21 N O2
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Formal charge
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0
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Molecular weight
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187.279 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
12.01 |
O=C(O)C(N)(CCCCCCC)C |
SMILES
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CACTVS |
3.370 |
CCCCCCC[C](C)(N)C(O)=O |
SMILES
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OpenEye OEToolkits |
1.7.6 |
CCCCCCCC(C)(C(=O)O)N |
Canonical SMILES
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CACTVS |
3.370 |
CCCCCCC[C@@](C)(N)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.7.6 |
CCCCCCC[C@](C)(C(=O)O)N |
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IUPAC InChI | InChI=1S/C10H21NO2/c1-3-4-5-6-7-8-10(2,11)9(12)13/h3-8,11H2,1-2H3,(H,12,13)/t10-/m1/s1 |
IUPAC InChI key | MLEJPUOWUJAQAF-SNVBAGLBSA-N |
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wwPDB Information |
Atom count
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34 (13 without Hydrogen)
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Polymer type
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Amino Acid
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Type description
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D-PEPTIDE LINKING
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Type code
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ATOMP
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Is modified
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No
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Standard parent
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Not Assigned
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Defined at
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2011-12-26
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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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