Basic information
- Standard SMILES
C[C@@H](c1cn(C(=O)OC(C)(C)C)c2ccccc12)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O- InChIKey
ROZQVAXJMBKHLK-VKGTZQKMSA-N- Molecular formula
- C32H32N2O6
- Average molar mass
- 540.6 g/mol
Names & identifiers
- Preferred name
- (2S,3S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(1-(tert-butoxycarbonyl)-1H-indol-3-yl)butanoic acid
- IUPAC
- (2S,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]butanoic acid
Names & synonyms
SCHEMBL16100088SCHEMBL30229483ROZQVAXJMBKHLK-VKGTZQKMSA-N(2S,3S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(1-(tert-butoxycarbonyl)-1H-indol-3-yl)butanoic acid
Database identifiers
- PubChem CID
- 11307239
- Nikkaji
- J1.530.140F
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 911
Related reactions
1 records
Compound notes
Loading…