Molecule

(2S,3S,4S,5S,6R)-6-[(1S)-2-{[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-hydroxyethyl]oxane-2,3,4,5-tetrol

AlkaPlorer ID: AK257970

Synonym: None

IUPAC Name: (2S,3S,4S,5S,6R)-6-[(1S)-2-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-hydroxyethyl]oxane-2,3,4,5-tetrol

Structure

SMILES: N[C@H]1[C@@H](OC[C@H](O)[C@H]2O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O

InChI: InChI=1S/C13H25NO11/c14-5-7(18)6(17)4(1-15)24-13(5)23-2-3(16)11-9(20)8(19)10(21)12(22)25-11/h3-13,15-22H,1-2,14H2/t3-,4+,5+,6+,7+,8-,9-,10-,11+,12-,13-/m0/s1

InChIKey: JOLUNKOXJFOMSC-GECCHUQSSA-N

Reference

Structure of the K74 antigen from Escherichia coli O44:K74:H18, a capsular polysaccharide containing furanosidic β-KDO residues

PubChem CID: 162936367

LOTUS: LTS0055095

SuperNatural Ⅲ: SN0170958-01

NPASS: NPC128298

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Piper wallichii	Piper	Piperaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cribrochalina vasculum	Cribrochalina	Niphatidae	Haplosclerida	Demospongiae	Porifera	Metazoa	Eukaryota

Properties Information

Molecule Weight: 371.3390000000001

TPSA？: 215.55

MolLogP？: -6.069899999999992

Number of H-Donors: 9

Number of H-Acceptors: 12

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi