3LR
3,6-dideoxy-L-arabino-hexonic acid
Created: | 2008-05-01 |
Last modified: | 2020-06-05 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 23 |
Chiral Atom Count | 3 |
Bond Count | 22 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 3,6-dideoxy-L-arabino-hexonic acid |
Synonyms | 3-deoxy-L-rhamnonic acid |
Systematic Name (OpenEye OEToolkits) | (2R,4R,5S)-2,4,5-trihydroxyhexanoic acid |
Formula | C6 H12 O5 |
Molecular Weight | 164.156 |
Type | L-SACCHARIDE |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(O)CC(O)C(O)C |
SMILES | CACTVS | 3.341 | C[CH](O)[CH](O)C[CH](O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(C(CC(C(=O)O)O)O)O |
Canonical SMILES | CACTVS | 3.341 | C[C@H](O)[C@H](O)C[C@@H](O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C[C@@H]([C@@H](C[C@H](C(=O)O)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C6H12O5/c1-3(7)4(8)2-5(9)6(10)11/h3-5,7-9H,2H2,1H3,(H,10,11)/t3-,4+,5+/m0/s1 |
InChIKey | InChI | 1.03 | RJZYGPZBSUBNEJ-VPENINKCSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 24901727 |