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Basic information
- CAS
120996-02-3- Standard SMILES
CCCCCCCCCCCCCCCCCCOCC(O)COC1OC(C)C(O)C(O)C1O- InChIKey
HXLCWNWPRPDFMM-UHFFFAOYSA-N- Molecular formula
- C27H54O7
- Average molar mass
- 490.7 g/mol
- Monoisotopic mass
- 490.38695406
Names & identifiers
- Preferred name
- 2-(2-Hydroxy-3-octadecoxypropoxy)-6-methyloxane-3,4,5-triol
- IUPAC
- 2-(2-hydroxy-3-octadecoxypropoxy)-6-methyloxane-3,4,5-triol
Names & synonyms
120996-02-32-(2-hydroxy-3-octadecoxypropoxy)-6-methyloxane-3,4,5-triolDTXSID009236292-Hydroxy-3-(octadecyloxy)propyl 6-deoxyhexopyranoside
Database identifiers
- CAS
120996-02-3- PubChem CID
- 180002
- DTXSID
DTXSID00923629
Properties
Computed structural propertiesFilling in
- XLogP
- 6.5
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 22
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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