Basic information
- Standard SMILES
CCCCC[C@@H](/C=C/[C@@H]1C(SCCCCCC(=O)O)=C(OC(=O)CCC)C[C@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C- InChIKey
CBPKDJLCGLFXIN-CYEYXGKASA-N- Molecular formula
- C35H66O6SSi2
- Average molar mass
- 671.1 g/mol
Names & identifiers
- Preferred name
- (11R,12S,13E,15S)-9-butyryloxy-11,15-bis(tert-butyldimethylsiloxy)-7-thiaprosta-8,13-dienoic acid
- IUPAC
- 6-[(4R,5S)-2-butanoyloxy-4-[tert-butyl(dimethyl)silyl]oxy-5-[(E,3S)-3-[tert-butyl(dimethyl)silyl]oxyoct-1-enyl]cyclopenten-1-yl]sulfanylhexanoic acid
Names & synonyms
SCHEMBL6653101CBPKDJLCGLFXIN-CYEYXGKASA-N(11R,12S,13E,15S)-9-butyryloxy-11,15-bis(tert-butyldimethylsiloxy)-7-thiaprosta-8,13-dienoic acid
Database identifiers
- PubChem CID
- 22883780
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 23
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 961
Related reactions
2 records
Linked notes
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