| Phytochemical Name : Isophytol |
| PCNDIDI0099 |
| Pubchem CID : 10453 |
| Molecular formula: C20H40O |
| Canonical SMILES : CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O |
Synonymes : ISOPHYTOL|505-32-8|3,7,11,15-Tetramethylhexadec-1-en-3-ol|3,7,11,15-Tetramethyl-1-hexadecen-3-ol|1-Hexadecen-3-ol, 3,7,11,15-tetramethyl-|NSC 93744|2,6,10,14-Tetramethylhexadec-15-en-14-ol|HSDB 5673|2,6,10-Trimethyl-14-vinylpentadecan-14-ol|EINECS 208-008-8|UNII-A831ZI6VIM|A831ZI6VIM|AI3-25090|DTXSID2025474|NSC-93744|1-Hexadecene-3-ol, 3,7,11,15-tetramethyl|EC 208-008-8|1-phyten-3-ol|Isophytol, >95%|ISOPHYTOL [MI]|ISOPHYTOL [HSDB]|Isophytol, >=97.0%|SCHEMBL21429|MLS002415735|CHEMBL453797|DTXCID005474|HMS3039F03|NSC93744|Tox21_200139|MFCD00048380|STK675859|AKOS005593873|HY-W127745|LS-1313|NCGC00090800-01|NCGC00090800-02|NCGC00090800-03|NCGC00257693-01|AC-19997|BS-42420|CAS-505-32-8|SMR001370903|3,7,11,15-tetramethyl-1-hexadecene-3-ol|CS-0185936|FT-0632244|I0145|1-hexadecen-3-ol, 3,7,11,15-tetrametil-|1-Hexadecyl-3-ol, 3,7,11,15-tetramethyl|3,7,11,15-Tetramethyl-1-hexa-decen-3-ol|3,7,11,15-Tetramethyl-1-hexadecen-3-ol #|D91087|3,7,11,15-tetramethyl-3-hydroxy-1-hexadecene|Hexadec-1-en-3-ol, 3,7,11,15-tetramethyl-|1-Hexadecen-3-ol,7,11,15-tetramethyl- (VAN8C|SR-01000526357|SR-01000526357-1|W-105953|1-Hexadecen-3-ol, 3,7,11,15-tetramethyl- (VAN)|Q26841319|3,7,11,15 - tetramethylhexadec - 1 - en - 3 - ol|1-Hexadecen-3-ol, 3,7,11,15-tetramethyl- (VAN) (8CI) |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.880 |
| Log Po/w (XLOGP3) : 7.830 |
| Log Po/w (WLOGP) : 6.360 |
| Log Po/w (MLOGP) : 5.250 |
| Log Po/w (SILICOS-IT) : 6.570 |
| Consensus Log Po/w : 6.180 |