Basic information
- CAS
94722-74-4- Standard SMILES
O=C(O)[C@@]1(O[C@@H]2C[C@](O)(C(=O)O)O[C@H]([C@H](O)CO)[C@@H]2O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O1- InChIKey
SRIXLBAWSGGPTF-NNZUOWEZSA-N- Molecular formula
- C16H26O15
- Average molar mass
- 458.37 g/mol
- Monoisotopic mass
- 458.12717012
Overview
Alpha-Kdo-(2->4)-alpha-Kdo is a disaccharide consisting of two 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl units joined via an alpha-(24)-linkage.
Names & identifiers
- Preferred name
- 3-Deoxy-4-O-(3-deoxy-alpha-D-manno-2-octulopyranosonosyl)-alpha-D-manno-2-octulopyranosonic acid
- IUPAC
- (2R,4R,5R,6R)-2-[(2R,4R,5R,6R)-2-carboxy-6-[(1R)-1,2-dihydroxyethyl]-2,5-dihydroxyoxan-4-yl]oxy-6-[(1R)-1,2-dihydroxyethyl]-4,5-dihydroxyoxane-2-carboxylic acid
- English name
- 3-deoxyoctulosonic acid-(alpha-2-4)-3-deoxyoctulosonic acid
- Molecular formula
- C16H26O15
- Molecular weight
- 458.36864
Names & synonyms
3-Dodo3-Deoxyoctulosonic acid disaccharide3-Deoxy-D-manno-octulosonic acid disaccharide3-Deoxyoctulosonic acid-(alpha-2-4)-3-deoxyoctulosonic acid94722-74-4alpha-D-Manno-2-octulopyranosonic acid, 3-deoxy-4-O-(3-deoxy-alpha-D-manno-2-oculopyranosonosyl)-, (5alpha,6beta)-RefChem:911274GlyTouCan:G36348JQG36348JQ3-Deoxy-4-O-(3-deoxy-alpha-D-manno-2-octulopyranosonosyl)-alpha-D-manno-2-octulopyranosonic acidalpha-Kdo-(2->4)-alpha-KdoKdo2
Show more names
Kdo(2->4)Kdo
CHEBI:472183-deoxy-4-O-(3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl)-alpha-D-manno-oct-2-ulopyranosonic acid3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acidKdoalpha2-4KdoalphaEpitope ID:130659SCHEMBL29394374DTXSID20915349Q27120773
Database identifiers
Properties
Computed structural properties
- XLogP
- -4.7
- Topological polar surface area
- 264 Ų
- Hydrogen bond donors
- 10
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 659
Chemistry & industry
Additional notes
DefinitionChEBI: Alpha-Kdo-(2->4)-alpha-Kdo is a disaccharide consisting of two 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl units joined via an alpha-(2->4)-linkage.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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