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SST : Summary
Code ![](/pdbe/static/images/help.png)
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SST
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One-letter code ![](/pdbe/static/images/help.png)
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X
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Molecule name ![](/pdbe/static/images/help.png)
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L-arabinitol
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Synonyms ![](/pdbe/static/images/help.png)
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(2S,4S)-pentane-1,2,3,4,5-pentol
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Systematic names ![](/pdbe/static/images/help.png)
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Formula ![](/pdbe/static/images/help.png)
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C5 H12 O5
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Formal charge ![](/pdbe/static/images/help.png)
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0
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Molecular weight ![](/pdbe/static/images/help.png)
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152.146 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
12.01 |
OC(CO)C(O)C(O)CO |
SMILES
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CACTVS |
3.385 |
OC[CH](O)[CH](O)[CH](O)CO |
SMILES
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OpenEye OEToolkits |
1.7.6 |
C(C(C(C(CO)O)O)O)O |
Canonical SMILES
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CACTVS |
3.385 |
OC[C@H](O)[C@@H](O)[C@@H](O)CO |
Canonical SMILES
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OpenEye OEToolkits |
1.7.6 |
C([C@@H](C([C@H](CO)O)O)O)O |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4-/m0/s1 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | HEBKCHPVOIAQTA-IMJSIDKUSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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22 (10 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Bound ligand
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Type description ![](/pdbe/static/images/help.png)
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NON-POLYMER
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Type code ![](/pdbe/static/images/help.png)
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ATOMS
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Is modified ![](/pdbe/static/images/help.png)
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No
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Standard parent ![](/pdbe/static/images/help.png)
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Not Assigned
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Defined at ![](/pdbe/static/images/help.png)
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2014-09-02
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Last modified at ![](/pdbe/static/images/help.png)
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2020-06-17
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Status ![](/pdbe/static/images/help.png)
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Released
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Obsoleted ![](/pdbe/static/images/help.png)
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Not Assigned
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