Basic information
- Standard SMILES
CC(C)(C)C(=O)OC[C@H]1O[C@@H](S(=O)c2ccccc2)[C@H](OC(=O)C(C)(C)C)[C@@H](OC(=O)C(C)(C)C)[C@H]1OC(=O)C(C)(C)C- InChIKey
VBHQHJWENQBJRF-MZULQBAQSA-N- Molecular formula
- C32H48O10S
- Average molar mass
- 624.8 g/mol
Names & identifiers
- Preferred name
- 1-deoxy-1-(phenylsulfinyl)-2,3,4,6-tetra-O-pivaloyl-beta-D-galactopyranose
- IUPAC
- [(2R,3S,4S,5R,6S)-6-(benzenesulfinyl)-3,4,5-tris(2,2-dimethylpropanoyloxy)oxan-2-yl]methyl 2,2-dimethylpropanoate
Names & synonyms
SCHEMBL7997401VBHQHJWENQBJRF-MZULQBAQSA-N1-deoxy-1-(phenylsulfinyl)-2,3,4,6-tetra-O-pivaloyl-beta-D-galactopyranose(2S,3R,4S,5S,6R)-2-(Phenylsulfinyl)-6-((pivaloyloxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl tris(2,2-dimethylpropanoate)157239-66-2
Database identifiers
- PubChem CID
- 10865083
- Nikkaji
- J1.753.938H
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 15
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,030
Related reactions
1 records
Compound notes
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