(2R)-N-[(1S,2S,3R)-1-[(alpha-D-Galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl]-2-hydroxytetracosanamide

Base Information

• Chemical Name: (2R)-N-[(1S,2S,3R)-1-[(alpha-D-Galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl]-2-hydroxytetracosanamide
• CAS No.: 148347-42-6
• Molecular Formula: C48H95 N O10
• DSSTox Substance ID: DTXSID901111095
• Nikkaji Number: J671.938D
• Metabolomics Workbench ID: 174195

Synonyms:SCHEMBL5959836;DTXSID901111095;(2R)-N-[(1S,2S,3R)-1-[(alpha-D-Galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl]-2-hydroxytetracosanamide;[(2S,3S,4R)-2-[[(R)-2-Hydroxytetracosanoyl]amino]-3,4-dihydroxyoctadecyl]alpha-D-galactopyranoside;148347-42-6

Chemical Property of (2R)-N-[(1S,2S,3R)-1-[(alpha-D-Galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl]-2-hydroxytetracosanamide

Chemical Property:

• XLogP3: 14.2
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 42
• Exact Mass: 845.69559823
• Heavy Atom Count: 59
• Complexity: 930

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C(CCCCCCCCCCCCCC)O)O)O
• Isomeric SMILES: CCCCCCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@@H](CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)[C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)O

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