4-O-tetradecanoyl-2,3-dideoxyglucono-1,5-lactone
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Basic information
- CAS
153764-21-7- Standard SMILES
CCCCCCCCCCCCCC(=O)O[C@H]1CCC(=O)O[C@@H]1CO- InChIKey
CYZQSJDYZVYMPX-ZWKOTPCHSA-N- Molecular formula
- C20H36O5
- Average molar mass
- 356.5 g/mol
- Monoisotopic mass
- 356.25627424
Overview
RN refers to (D)-isomer; structure in first source
Names & identifiers
- Preferred name
- 4-O-tetradecanoyl-2,3-dideoxyglucono-1,5-lactone
- IUPAC
- [(2R,3S)-2-(hydroxymethyl)-6-oxooxan-3-yl] tetradecanoate
- English name
- 4-O-tetradecanoyl-2,3-dideoxyglucono-1,5-lactone
- Molecular formula
- C20H36O5
- Molecular weight
- 356.5
Names & synonyms
4-O-Tetradecanoyl-2,3-dideoxyglucono-1,5-lactone153764-21-74-O-C14-DDGLRefChem:100242[(2R,3S)-2-(hydroxymethyl)-6-oxooxan-3-yl] tetradecanoateCHEMBL1502972,3-Dideoxy-D-erythro-Hexonic acid delta-lactone, 5-tetradecanoateD-erythro-Hexonic acid, 2,3-dideoxy-, delta-lactone, 5-tetradecanoateD-erythro-Hexonic acid, 2,3-dideoxy-, δ-lactone, 4-tetradecanoate
Database identifiers
- CAS
153764-21-7- PubChem CID
- 160385
- ChEMBL
CHEMBL150297
Properties
Computed structural propertiesFilling in
- XLogP
- 5.8
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 15
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 369
Related reactions
0 records
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Compound notes
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