GL5
Summary
Name: | (5S,7R,8S,9S,10R)-3,8,9,10-tetrahydroxy-7-(hydroxymethyl)-6-oxa-1,3-diazaspiro[4.5]decane-2,4-dione |
Synonyms: | 3,8,9,10-TETRAHYDROXY-7-HYDROXYMETHYL-6-OXA-1,3-DIAZA-SPIRO[4.5]DECANE-2,4-DIONE |
Formula: | C8 H12 N2 O8 |
Formal charge: | 0 |
Formula weight: | 264.189 Da |
Component type: | D-saccharide |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (5S,7R,8S,9S,10R)-3,8,9,10-tetrahydroxy-7-(hydroxymethyl)-6-oxa-1,3-diazaspiro[4.5]decane-2,4-dione |
OpenEye OEToolkits | 1.5.0 | (5S,6R,7S,8S,9R)-3,6,7,8-tetrahydroxy-9-(hydroxymethyl)-10-oxa-1,3-diazaspiro[4.5]decane-2,4-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C2N(O)C(=O)NC21OC(C(O)C(O)C1O)CO |
SMILES_CANONICAL | CACTVS | 3.341 | OC[C@H]1O[C@@]2(NC(=O)N(O)C2=O)[C@H](O)[C@@H](O)[C@@H]1O |
SMILES | CACTVS | 3.341 | OC[CH]1O[C]2(NC(=O)N(O)C2=O)[CH](O)[CH](O)[CH]1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@H]([C@@H]([C@H]([C@]2(O1)C(=O)N(C(=O)N2)O)O)O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(C(C(C2(O1)C(=O)N(C(=O)N2)O)O)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C8H12N2O8/c11-1-2-3(12)4(13)5(14)8(18-2)6(15)10(17)7(16)9-8/h2-5,11-14,17H,1H2,(H,9,16)/t2-,3-,4+,5-,8+/m1/s1 |
InChIKey | InChI | 1.03 | IHDZZZHACPJCFJ-WWHASAIZSA-N |