N-[[6-(2,3-dimethoxypropyl)-4-hydroxy-5,5-dimethyl-tetrahydropyran-2-yl]-methoxy-methyl]-2-hydroxy-2-(2-methoxy-5,6-dimethyl-4-methylene-tetrahydropyran-2-yl)acetamide
Basic information
- CAS
27973-72-4- Standard SMILES
C=C1CC(OC)(C(O)C(=O)NC(OC)C2CC(O)C(C)(C)C(CC(COC)OC)O2)OC(C)C1C- InChIKey
ZNEZZONMADKYTB-UHFFFAOYSA-N- Molecular formula
- C25H45NO9
- Average molar mass
- 503.6 g/mol
- Monoisotopic mass
- 503.30943201
Names & identifiers
- Preferred name
- N-[[6-(2,3-dimethoxypropyl)-4-hydroxy-5,5-dimethyl-tetrahydropyran-2-yl]-methoxy-methyl]-2-hydroxy-2-(2-methoxy-5,6-dimethyl-4-methylene-tetrahydropyran-2-yl)acetamide
- IUPAC
- N-[[6-(2,3-dimethoxypropyl)-4-hydroxy-5,5-dimethyloxan-2-yl]-methoxymethyl]-2-hydroxy-2-(2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl)acetamide
Names & synonyms
NSC114781SCHEMBL230848882H-Puran-2-acetamide, N-[[6-(2,3-dimethoxypropyl)tetrahydro-4-hydroxy-5,5-dimethyl-2H-pyran-2-yl]tetrahydro-.alpha.-hydroxy-2-methoxy-5, 6-dimethyl-4-methylene-, [2S-[2.alpha.[R*[R*(2S*,5S*,6S*)]], 4.beta.,6.beta.(R*)]]-2H-Pyran-2-glycolamide, N-[[6-(2,3-dimethoxypropyl)tetrahydro-3-hydroxy-5,5-dimethyl-2H-pyran-2-yl]methoxymethyl]tetrahydro-2-methoxy-5,6-dimethyl-4-methylene-N-[[6-(2,3-dimethoxypropyl)-4-hydroxy-5,5-dimethyl-tetrahydropyran-2-yl]-methoxy-methyl]-2-hydroxy-2-(2-methoxy-5,6-dimethyl-4-methylene-tetrahydropyran-2-yl)acetamide
Database identifiers
- CAS
27973-72-4- PubChem CID
- 494094
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 717
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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