(2E,15Z)-14-Methyl-2,15-octadecadien-1-ol
PubChem CID: 5364411
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | YRNXEZHGFXYCNB-OBDKPFBMSA-N, (2E,15Z)-14-Methyl-2,15-octadecadien-1-ol # |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Fatty alcohols |
| Deep Smiles | OC/C=C/CCCCCCCCCCC/C=CCC))))C |
| Heavy Atom Count | 20.0 |
| Classyfire Class | Fatty acyls |
| Classyfire Subclass | Fatty alcohols |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 230.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (2E,15Z)-14-methyloctadeca-2,15-dien-1-ol |
| Veber Rule | False |
| Classyfire Superclass | Lipids and lipid-like molecules |
| Xlogp | 7.3 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C19H36O |
| Inchi Key | YRNXEZHGFXYCNB-OBDKPFBMSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 14.0 |
| Synonyms | (2e,15z)-14-methyl-2,15-octadecadien-1-ol |
| Esol Class | Moderately soluble |
| Functional Groups | C/C=C/C, C/C=CC, CO |
| Compound Name | (2E,15Z)-14-Methyl-2,15-octadecadien-1-ol |
| Exact Mass | 280.277 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 280.277 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 280.5 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 2.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C19H36O/c1-3-4-16-19(2)17-14-12-10-8-6-5-7-9-11-13-15-18-20/h4,13,15-16,19-20H,3,5-12,14,17-18H2,1-2H3/b15-13+,16-4- |
| Smiles | CC/C=C\C(C)CCCCCCCCCC/C=C/CO |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 2.0 |
| Egan Rule | False |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Rungia Pectinata (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2016.1197800