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AML : Summary
Code
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AML
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One-letter code
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X
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Molecule name
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AMYLAMINE
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Systematic names
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|
Formula
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C5 H13 N
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Formal charge
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0
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Molecular weight
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87.163 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
NCCCCC |
SMILES
|
CACTVS |
3.341 |
CCCCCN |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
CCCCCN |
Canonical SMILES
|
CACTVS |
3.341 |
CCCCCN |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
CCCCCN |
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IUPAC InChI | InChI=1S/C5H13N/c1-2-3-4-5-6/h2-6H2,1H3 |
IUPAC InChI key | DPBLXKKOBLCELK-UHFFFAOYSA-N |
Is part of |
PN4
|
|
wwPDB Information |
Atom count
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19 (6 without Hydrogen)
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Polymer type
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Bound ligand
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Type description
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NON-POLYMER
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Type code
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HETAIN
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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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2001-07-05
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Last modified at
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2011-06-04
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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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