Basic information
- Standard SMILES
CCCCCCCOC(=O)[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)C(=O)OCCCCCCC- InChIKey
XWRCGQAEFSEELQ-FZDBZEDMSA-N- Molecular formula
- C20H38O8
- Average molar mass
- 406.5 g/mol
Names & identifiers
- Preferred name
- Diheptyl galactarate
- IUPAC
- diheptyl (2S,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioate
Names & synonyms
diheptyl galactarateXWRCGQAEFSEELQ-FZDBZEDMSA-N
Database identifiers
- PubChem CID
- 131737197
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 19
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 377
Related reactions
1 records
Linked notes
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