1-Phytanoic acid; (3S,7R,11R)-form, (2-Methylsulfonylethyl)amide
AlkaPlorer ID: AK310420
Synonym: Sinulasulfone
IUPAC Name: 3,7,11,15-tetramethyl-N-(2-methylsulfonylethyl)hexadecanamide
Structure
SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)NCCS(C)(=O)=O
InChI: InChI=1S/C23H47NO3S/c1-19(2)10-7-11-20(3)12-8-13-21(4)14-9-15-22(5)18-23(25)24-16-17-28(6,26)27/h19-22H,7-18H2,1-6H3,(H,24,25)
InChIKey: CECRDLCMVJASRD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sinularia sp. | Sinularia | Sinulariidae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 417.70000000000016
TPSA？: 63.24
MolLogP？: 5.612500000000005
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|