YTB
(1R,2R,3S,4R,5R)-5-aminocyclopentane-1,2,3,4-tetrol
Created: | 2008-07-25 |
Last modified: | 2011-06-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 21 |
Chiral Atom Count | 5 |
Bond Count | 21 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (1R,2R,3S,4R,5R)-5-aminocyclopentane-1,2,3,4-tetrol |
Systematic Name (OpenEye OEToolkits) | (1R,2S,3R,4R)-5-aminocyclopentane-1,2,3,4-tetrol |
Formula | C5 H11 N O4 |
Molecular Weight | 149.145 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OC1C(N)C(O)C(O)C1O |
SMILES | CACTVS | 3.341 | N[CH]1[CH](O)[CH](O)[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 1.5.0 | C1(C(C(C(C1O)O)O)O)N |
Canonical SMILES | CACTVS | 3.341 | N[C@@H]1[C@@H](O)[C@H](O)[C@H](O)[C@@H]1O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C1([C@H]([C@@H]([C@@H]([C@@H]1O)O)O)O)N |
InChI | InChI | 1.03 | InChI=1S/C5H11NO4/c6-1-2(7)4(9)5(10)3(1)8/h1-5,7-10H,6H2/t1-,2-,3-,4+,5-/m1/s1 |
InChIKey | InChI | 1.03 | LZCRRHQKPAEPKL-PTSYSAGVSA-N |