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TGY : Summary
Code ![](/pdbe/static/images/help.png)
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TGY
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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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1-deoxy-alpha-D-tagatopyranose
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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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C6 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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164.156 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 |
C1(O)C(O)C(C(O)(C)OC1)O |
SMILES
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CACTVS |
3.385 |
C[C]1(O)OC[CH](O)[CH](O)[CH]1O |
SMILES
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OpenEye OEToolkits |
1.9.2 |
CC1(C(C(C(CO1)O)O)O)O |
Canonical SMILES
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CACTVS |
3.385 |
C[C@]1(O)OC[C@@H](O)[C@H](O)[C@@H]1O |
Canonical SMILES
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OpenEye OEToolkits |
1.9.2 |
C[C@]1([C@H]([C@H]([C@@H](CO1)O)O)O)O |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C6H12O5/c1-6(10)5(9)4(8)3(7)2-11-6/h3-5,7-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | YLWWLYACYNLGLT-VANKVMQKSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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23 (11 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Saccharide
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Type description ![](/pdbe/static/images/help.png)
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D-saccharide, alpha linking
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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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2015-03-26
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Last modified at ![](/pdbe/static/images/help.png)
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2020-07-17
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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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