alpha-L-Fucp-(1->4)-[beta-D-Galp3S-(1->3)]-beta-D-GlcpNAc

Base Information

• Chemical Name: alpha-L-Fucp-(1->4)-[beta-D-Galp3S-(1->3)]-beta-D-GlcpNAc
• CAS No.: 153088-71-2
• Molecular Formula: C20H35 N O18 S
• Molecular Weight: 645.56
• DSSTox Substance ID: DTXSID60415358
• Nikkaji Number: J1.639.971J
• Wikidata: Q27133695
• Metabolomics Workbench ID: 63717
• Mol file: 153088-71-2.mol

Synonyms:153088-71-2;alpha-L-Fucp-(1->4)-[beta-D-Galp3S-(1->3)]-beta-D-GlcpNAc;3'-Sulfated Lewis A;[(2R,3R,4S,5S,6R)-2-[(2R,3R,4R,5S,6R)-3-acetamido-2-hydroxy-6-(hydroxymethyl)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate;[3OSO3]Galbeta1-3(Fucalpha1-4)GlcNAcbeta;alpha-L-Fuc-(1->4)-[beta-D-Gal3S-(1->3)]-beta-D-GlcNAc;alpha-L-fucosyl-(1->4)-[3-O-sulfo-beta-D-galactosyl-(1->3)]-N-acetyl-beta-D-glucosamine;6-deoxy-alpha-L-galactopyranosyl-(1->4)-[3-O-sulfo-beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranose;alpha-L-fucopyranosyl-(1->4)-[3-O-sulfo-beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranose;1fwv;CHEBI:65149;DTXSID60415358;(3S)Galb1-3(Fuca1-4)GlcNAcb;(3S)Galbeta1-3(Fucalpha1-4)GlcNAcbeta;Q27133695;N-Acetyl-3-O-(3-O-sulfo-beta-D-galactopyranosyl)-4-O-alpha-L-fucopyranosyl-beta-D-glucosamine

Chemical Property of alpha-L-Fucp-(1->4)-[beta-D-Galp3S-(1->3)]-beta-D-GlcpNAc

Chemical Property:

• PSA: 311.90000
• LogP: -5.05530
• XLogP3: -6.2
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 9
• Exact Mass: 609.15748444
• Heavy Atom Count: 40
• Complexity: 950

Purity/Quality:

98%Min ^*data from raw suppliers

3?-SulfatedLewisA ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(OC(C(C2OC3C(C(C(C(O3)CO)O)OS(=O)(=O)O)O)NC(=O)C)O)CO)O)O)O
• Isomeric SMILES: C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)OS(=O)(=O)O)O)NC(=O)C)O)CO)O)O)O
• Uses: prevents ischemia reperfusion lung injury