Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCNc1ccc(C(=O)C(=O)C(O)CO)cc1- InChIKey
DQHBCHOIEPPZPP-UHFFFAOYSA-N- Molecular formula
- C26H43NO4
- Average molar mass
- 433.6 g/mol
- Monoisotopic mass
- 433.31920885
Names & identifiers
- Preferred name
- 4-(n-Hexadecylamino)benzoyl glyceraldehyde
- IUPAC
- 1-[4-(hexadecylamino)phenyl]-3,4-dihydroxybutane-1,2-dione
Names & synonyms
SCHEMBL11545983DQHBCHOIEPPZPP-UHFFFAOYSA-N4-(n-hexadecylamino)benzoyl glyceraldehyde
Database identifiers
- PubChem CID
- 21326953
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 86.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 20
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 460
Related reactions
3 records
Compound notes
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