Basic information
- Standard SMILES
CS[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1N1C(=O)c2ccccc2C1=O- InChIKey
QNHCRERIIKDXAI-YKGACUOXSA-N- Molecular formula
- C21H23NO9S
- Average molar mass
- 465.5 g/mol
Names & identifiers
- Preferred name
- Methyl 3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-1-thio-beta-D-galactopyranoside
- IUPAC
- [(2R,3R,4R,5R,6S)-3,4-diacetyloxy-5-(1,3-dioxoisoindol-2-yl)-6-methylsulfanyloxan-2-yl]methyl acetate
Names & synonyms
SCHEMBL8824329QNHCRERIIKDXAI-YKGACUOXSA-NMethyl 3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-1-thio-beta-D-galactopyranoside
Database identifiers
- PubChem CID
- 11059664
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 763
Related reactions
1 records
Compound notes
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