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PLM : Summary
Code 
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PLM
|
One-letter code 
|
X
|
Molecule name 
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PALMITIC ACID
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Systematic names 
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Formula 
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C16 H32 O2
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Formal charge 
|
0
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Molecular weight 
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256.424 Da
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SMILES 
|
Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)CCCCCCCCCCCCCCC |
SMILES
|
CACTVS |
3.341 |
CCCCCCCCCCCCCCCC(O)=O |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
CCCCCCCCCCCCCCCC(=O)O |
Canonical SMILES
|
CACTVS |
3.341 |
CCCCCCCCCCCCCCCC(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
CCCCCCCCCCCCCCCC(=O)O |
|
IUPAC InChI  | InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18) |
IUPAC InChI key  | IPCSVZSSVZVIGE-UHFFFAOYSA-N |
|
wwPDB Information |
Atom count 
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50 (18 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 
|
HETAIN
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Is modified 
|
No
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Standard parent 
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Not Assigned
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Defined at 
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1999-07-08
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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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