GL9
Summary
Name: | N-[(5S,7R,8S,9S,10R)-8,9,10-trihydroxy-7-(hydroxymethyl)-2,4-dioxo-6-oxa-1,3-diazaspiro[4.5]dec-3-yl]acetamide |
Synonyms: | N-(8,9,10-TRIHYDROXY-7-HYDROXYMETHYL-2,4-DIOXO-6-OXA-1,3-DIAZA-SPIRO[4.5]DEC-3-YL-ACETAMIDE |
Formula: | C10 H15 N3 O8 |
Formal charge: | 0 |
Formula weight: | 305.241 Da |
Component type: | D-saccharide |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | N-[(5S,7R,8S,9S,10R)-8,9,10-trihydroxy-7-(hydroxymethyl)-2,4-dioxo-6-oxa-1,3-diazaspiro[4.5]dec-3-yl]acetamide |
OpenEye OEToolkits | 1.5.0 | N-[(5S,6R,7S,8S,9R)-6,7,8-trihydroxy-9-(hydroxymethyl)-2,4-dioxo-10-oxa-1,3-diazaspiro[4.5]decan-3-yl]ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C2N(C(=O)NC21OC(C(O)C(O)C1O)CO)NC(=O)C |
SMILES_CANONICAL | CACTVS | 3.341 | CC(=O)NN1C(=O)N[C@@]2(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O |
SMILES | CACTVS | 3.341 | CC(=O)NN1C(=O)N[C]2(O[CH](CO)[CH](O)[CH](O)[CH]2O)C1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(=O)NN1C(=O)[C@@]2([C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)NC1=O |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(=O)NN1C(=O)C2(C(C(C(C(O2)CO)O)O)O)NC1=O |
InChI | InChI | 1.03 | InChI=1S/C10H15N3O8/c1-3(15)12-13-8(19)10(11-9(13)20)7(18)6(17)5(16)4(2-14)21-10/h4-7,14,16-18H,2H2,1H3,(H,11,20)(H,12,15)/t4-,5-,6+,7-,10+/m1/s1 |
InChIKey | InChI | 1.03 | MAHIOGAAEAWGLR-UTAYWCBXSA-N |