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ORD : Summary
Code
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ORD
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One-letter code
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X
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Molecule name
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D-ORNITHINE
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Systematic names
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Formula
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C5 H12 N2 O2
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Formal charge
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0
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Molecular weight
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132.161 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)C(N)CCCN |
SMILES
|
CACTVS |
3.352 |
NCCC[CH](N)C(O)=O |
SMILES
|
OpenEye OEToolkits |
1.6.1 |
C(CC(C(=O)O)N)CN |
Canonical SMILES
|
CACTVS |
3.352 |
NCCC[C@@H](N)C(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.6.1 |
C(C[C@H](C(=O)O)N)CN |
|
IUPAC InChI | InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m1/s1 |
IUPAC InChI key | AHLPHDHHMVZTML-SCSAIBSYSA-N |
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wwPDB Information |
Atom count
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21 (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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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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2010-09-08
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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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