CHEBI:77923 - sodium[α-Kdo-(2→8)-α-Kdo-OAll II1,I7-lactone]

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name sodium[α-Kdo-(2→8)-α-Kdo-OAll II1,I7-lactone]
ChEBI ID CHEBI:77923
ChEBI ASCII Name sodium[alpha-Kdo-(2->8)-alpha-Kdo-OAll II(1),I(7)-lactone]
Definition The sodium salt of a carbohydrate lactone formed from α-Kdo-(2→8)-α-Kdo-OAll by lactone formation between the carboxy group of the non-reducing α-Kdo residue and O-7 of the α-Kdo-OAll residue.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H27NaO14
Net Charge 0
Average Mass 502.39900
Monoisotopic Mass 502.12985
InChI InChI=1S/C19H28O14.Na/c1-2-3-29-18(16(26)27)4-8(21)13(25)15(33-18)11-7-30-19(17(28)31-11)5-9(22)12(24)14(32-19)10(23)6-20;/h2,8-15,20-25H,1,3-7H2,(H,26,27);/q;+1/p-1/t8-,9-,10-,11-,12-,13-,14-,15-,18-,19-;/m1./s1
InChIKey CMRYYCZEIZHONA-WFFHLMICSA-M
SMILES [Na+].OC[C@@H](O)[C@H]1O[C@@]2(C[C@@H](O)[C@H]1O)OC[C@@H](OC2=O)[C@H]1O[C@@](C[C@@H](O)[C@H]1O)(OCC=C)C([O-])=O
ChEBI Ontology
Outgoing sodium[α-Kdo-(2→8)-α-Kdo-OAll II1,I7-lactone] (CHEBI:77923) has part α-Kdo-(2→8)-α-Kdo-OAll(1−) II1,I7-lactone (CHEBI:77925)
sodium[α-Kdo-(2→8)-α-Kdo-OAll II1,I7-lactone] (CHEBI:77923) is a organic sodium salt (CHEBI:38700)
IUPAC Name
sodium 3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→8)-(prop-2-en-1-yl 3-deoxy-α-D-manno-oct-2-ulopyranosid)onate II1,I7-lactone
Synonyms Sources
[α-Kdo-(2→8)-α-Kdo-OAll II1,I7-lactone] sodium salt ChEBI
Kdo-(2→8)-Kdo-1.7-lactone allyl glycoside sodium salt ChEBI
Na[α-Kdo-(2→8)-α-Kdo-OAll II1,I7-lactone] ChEBI
sodium (2R,4R,5R,6S)-2-(allyloxy)-6-{(3R,6R,8R,9R,10R)-8-[(1R)-1,2-dihydroxyethyl]-9,10-dihydroxy-5-oxo-1,4,7-trioxaspiro[5.5]undec-3-yl}-4,5-dihydroxytetrahydro-2H-pyran-2-carboxylate IUPAC
sodium 3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→8)-(allyl 3-deoxy-α-D-manno-oct-2-ulopyranosid)onate II1,I7-lactone ChEBI
Citation Waiting for Citations Type Source
19665108 PubMed citation Europe PMC
Last Modified
31 March 2014