Basic information
- Standard SMILES
C[C@H](OC1(c2ccccc2)c2ccccc2Oc2ccccc21)[C@@H](N)C(=O)O- InChIKey
JVZVOXRVIVJFDG-YCRPNKLZSA-N- Molecular formula
- C23H21NO4
- Average molar mass
- 375.4 g/mol
Names & identifiers
- Preferred name
- O-(9-Phenyl-9H-xanthen-9-yl)-D-threonine
- IUPAC
- (2R,3S)-2-amino-3-(9-phenylxanthen-9-yl)oxybutanoic acid
Names & synonyms
SCHEMBL7322679JVZVOXRVIVJFDG-YCRPNKLZSA-NO-(9-Phenyl-9H-xanthen-9-yl)-D-threonine
Database identifiers
- PubChem CID
- 53977557
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 525
Related reactions
1 records
Compound notes
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