EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H19NO14S |
| Net Charge | 0 |
| Average Mass | 433.344 |
| Monoisotopic Mass | 433.05263 |
| SMILES | O=C(O)C1=C(O)[C@H](O)[C@@H](O)C(O[C@H]2[C@H](O)[C@@H](NS(=O)(=O)O)C(O)O[C@@H]2CO)O1 |
| WURCS | WURCS=2.0/2,2,1/[a2122h-1x_1-5_2*NSO/3=O/3=O][a21EEA-1x_1-5]/1-2/a4-b1 |
| InChI | InChI=1S/C12H19NO14S/c14-1-2-8(4(15)3(11(21)25-2)13-28(22,23)24)26-12-7(18)5(16)6(17)9(27-12)10(19)20/h2-5,7-8,11-18,21H,1H2,(H,19,20)(H,22,23,24)/t2-,3-,4-,5+,7-,8-,11?,12?/m1/s1 |
| InChIKey | VXSFTKZNJZNDAP-VEVQCFNSSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| L-threo-hex-4-enopyranuronosyl-(1→4)-D-GlcpNS (CHEBI:149650) has functional parent N-sulfo-D-glucosamine (CHEBI:16702) |
| L-threo-hex-4-enopyranuronosyl-(1→4)-D-GlcpNS (CHEBI:149650) has functional parent 4,5-dehydro-D-glucuronic acid (CHEBI:43262) |
| L-threo-hex-4-enopyranuronosyl-(1→4)-D-GlcpNS (CHEBI:149650) is a disaccharide (CHEBI:36233) |
| Incoming Relation(s) |
| α-L-threo-hex-4-enopyranuronosyl-(1→4)-α-D-GlcpNS (CHEBI:147563) is a L-threo-hex-4-enopyranuronosyl-(1→4)-D-GlcpNS (CHEBI:149650) |
| β-L-threo-hex-4-enopyranuronosyl-(1→4)-β-D-GlcpNS (CHEBI:149385) is a L-threo-hex-4-enopyranuronosyl-(1→4)-D-GlcpNS (CHEBI:149650) |