Basic information
- Standard SMILES
CC(C)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OCC(O)C=CC(=O)OCc1ccccc1- InChIKey
LLQHASZDJQCKKA-UHFFFAOYSA-N- Molecular formula
- C32H33NO7
- Average molar mass
- 543.6 g/mol
- Monoisotopic mass
- 543.22570239
Names & identifiers
- IUPAC
- benzyl 5-[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoyl]oxy-4-hydroxypent-2-enoate
Database identifiers
- PubChem CID
- 76094986
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 14
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 845
Related reactions
2 records
Compound notes
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