Methyl 6-(2-acetamido-2-deoxy-alpha-glucopyranosyl phosphate)-alpha-mannopyranoside
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Basic information
- CAS
79671-06-0- Standard SMILES
COP(=O)(O)O[C@H]1O[C@H](C(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)C[C@H]1NC(C)=O- InChIKey
IXFYMCJRFMWVTF-NBCSYCFWSA-N- Molecular formula
- C15H28NO14P
- Average molar mass
- 477.35 g/mol
- Monoisotopic mass
- 477.12474156
Overview
structure given in first source
Names & identifiers
- Preferred name
- Methyl 6-(2-acetamido-2-deoxy-alpha-glucopyranosyl phosphate)-alpha-mannopyranoside
- IUPAC
- [(2R,3R,5S,6S)-3-acetamido-5-hydroxy-6-[hydroxy-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] methyl hydrogen phosphate
- English name
- methyl 6-(2-acetamido-2-deoxy-alpha-glucopyranosyl phosphate)-alpha-mannopyranoside
- Molecular weight
- 0
Names & synonyms
79671-06-0Methyl 6-(2-acetamido-2-deoxy-alpha-glucopyranosyl phosphate)-alpha-mannopyranosideRefChem:157713MadgpmN-Acglu-MM-6-PN-Acetylglucosamine 1'-(methylmannopyranose 6-monophosphate)N-Acetylglucosamine 1'-(alpha-D-methylmannopyranose 6-phosphate)alpha-D-Mannopyranoside, methyl 6-(2-(acetylamino)-2-deoxy-alpha-D-glucopyranosyl hydrogen phosphate)
Database identifiers
- CAS
79671-06-0- PubChem CID
- 133252
Properties
Computed structural propertiesFilling in
- XLogP
- -4.3
- Topological polar surface area
- 234 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 653
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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