Basic information
- Standard SMILES
CCOC(=O)C(=C[C@@H]1OC(C)(C)N(C(=O)OCc2ccccc2)[C@H]1CC(C)C)CCCOC1CCCCO1- InChIKey
VQOJOZYCCTXGMB-TXIPYEPDSA-N- Molecular formula
- C30H45NO7
- Average molar mass
- 531.7 g/mol
Names & identifiers
- Preferred name
- ethyl 3-[(4S,5S)-3-benzyloxycarbonyl-2,2-dimethyl-4-isobutyloxazolidine-5-yl]-2-[3-(2-tetrahydropyranyloxy)propyl]-2-propenoate
- IUPAC
- benzyl (4S,5S)-5-[2-ethoxycarbonyl-5-(oxan-2-yloxy)pent-1-enyl]-2,2-dimethyl-4-(2-methylpropyl)-1,3-oxazolidine-3-carboxylate
Names & synonyms
SCHEMBL7286978VQOJOZYCCTXGMB-TXIPYEPDSA-Nethyl 3-[(4S,5S)-3-benzyloxycarbonyl-2,2-dimethyl-4-isobutyloxazolidine- 5-yl]-2-[3-(2-tetrahydropyranyloxy)propyl]-2-propenoateethyl 3-[(4S,5S)-3-benzyloxycarbonyl-2,2-dimethyl-4-isobutyloxazolidine-5-yl]-2-[3-(2-tetrahydropyranyloxy)propyl]-2-propenoate
Database identifiers
- PubChem CID
- 70046087
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 14
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 775
Related reactions
2 records
Compound notes
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