| SpectraBase Spectrum ID |
EvDbRHeTMsP |
| Name |
1-Deoxy-1-[3-(3-nitrophenyl)-2-thioureido]-.beta.-d-glucopyranose 2,3,4,6-tetraacetate |
| Alternate Name(s) |
2,3,4,6-Tetra-O-acetyl-N-[(3-nitroanilino)carbothioyl]hexopyranosylamine
Acetic acid [3,4,5-triacetyloxy-6-[[(3-nitroanilino)-sulfanylidenemethyl]amino]-2-oxanyl]methyl ester
[3,4,5-triacetyloxy-6-[(3-nitrophenyl)carbamothioylamino]oxan-2-yl]methyl acetate
[3,4,5-triacetoxy-6-[(3-nitrophenyl)carbamothioylamino]tetrahydropyran-2-yl]methyl acetate
[3,4,5-triacetyloxy-6-[(3-nitrophenyl)carbamothioylamino]oxan-2-yl]methyl ethanoate
Acetic acid [3,4,5-triacetoxy-6-[(3-nitrophenyl)thiocarbamoylamino]tetrahydropyran-2-yl]methyl ester |
| Comments |
Structure changed after expert review |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25N3O11S |
| InChI |
InChI=1S/C21H25N3O11S/c1-10(25)31-9-16-17(32-11(2)26)18(33-12(3)27)19(34-13(4)28)20(35-16)23-21(36)22-14-6-5-7-15(8-14)24(29)30/h5-8,16-20H,9H2,1-4H3,(H2,22,23,36)/t16-,17-,18+,19-,20-/m1/s1 |
| InChIKey |
NVTQIDGQWGPKMN-OUUBHVDSSA-N |
| Molecular Weight |
527.501 g/mol |
| SMILES |
N([C@]1([C@@]([C@]([C@](OC(C)=O)([C@](O1)(COC(C)=O)[H])[H])(OC(C)=O)[H])(OC(C)=O)[H])[H])C(=S)Nc1cc(ccc1)[N+]([O-])=O |
| SPLASH |
splash10-0006-9200000000-0595b5f50c3087d0afc9 |
| Wiley ID |
1470222 |
![1-Deoxy-1-[3-(3-nitrophenyl)-2-thioureido]-.beta.-d-glucopyranose 2,3,4,6-tetraacetate](/api/spectrum/EvDbRHeTMsP/structure.png?h=300&w=458 "1-Deoxy-1-[3-(3-nitrophenyl)-2-thioureido]-.beta.-d-glucopyranose 2,3,4,6-tetraacetate")
