| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-05-25 21:17:58 UTC |
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| Update Date | 2016-11-09 01:17:46 UTC |
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| Accession Number | CHEM023796 |
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| Identification |
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| Common Name | Geranylgeraniol |
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| Class | Small Molecule |
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| Description | A geranylgeraniol in which all four double bonds have E- (trans-) geometry. |
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| Contaminant Sources | |
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| Contaminant Type | Not Available |
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| Chemical Structure | |
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| Synonyms | | Value | Source |
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| (2E,6E,10E)-Geranylgeraniol | ChEBI | | Geranylgeraniol, (e,e,e)-isomer | MeSH | | Geranylgeraniol, (Z,Z,Z)-isomer | MeSH | | Tetraprenol | MeSH | | (2E,6E,10E)-3,7,11,15-Tetramethyl-2,6,10,14-hexadecatetraen-1-ol | PhytoBank | | (E,E,E)-Geranylgeraniol | PhytoBank | | (E,E,E)-Geranylgeranyl alcohol | PhytoBank | | All-trans-Geranylgeraniol | PhytoBank | | Geranylgeraniol | PhytoBank | | Geranylgeranyl alcohol | PhytoBank | | trans,trans,trans-Geranylgeraniol | PhytoBank | | trans-Geranylgeraniol | PhytoBank |
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| Chemical Formula | C20H34O |
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| Average Molecular Mass | 290.483 g/mol |
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| Monoisotopic Mass | 290.261 g/mol |
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| CAS Registry Number | 24034-73-9 |
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| IUPAC Name | (2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol |
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| Traditional Name | geranylgeraniol |
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| SMILES | CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CO |
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| InChI Identifier | InChI=1S/C20H34O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15,21H,6-8,10,12,14,16H2,1-5H3/b18-11+,19-13+,20-15+ |
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| InChI Key | OJISWRZIEWCUBN-QIRCYJPOSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as acyclic diterpenoids. These are diterpenoids (compounds made of four consecutive isoprene units) that do not contain a cycle. |
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| Kingdom | Organic compounds |
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| Super Class | Lipids and lipid-like molecules |
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| Class | Prenol lipids |
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| Sub Class | Diterpenoids |
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| Direct Parent | Acyclic diterpenoids |
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| Alternative Parents | |
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| Substituents | - Acyclic diterpenoid
- Long chain fatty alcohol
- Fatty alcohol
- Fatty acyl
- Organic oxygen compound
- Hydrocarbon derivative
- Primary alcohol
- Organooxygen compound
- Alcohol
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | |
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| Biological Properties |
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| Status | Detected and Not Quantified |
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| Origin | Not Available |
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| Cellular Locations | Not Available |
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| Biofluid Locations | Not Available |
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| Tissue Locations | Not Available |
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| Pathways | Not Available |
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| Applications | Not Available |
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| Biological Roles | Not Available |
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| Chemical Roles | Not Available |
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| Physical Properties |
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| State | Not Available |
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| Appearance | Not Available |
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| Experimental Properties | | Property | Value |
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| Melting Point | Not Available | | Boiling Point | Not Available | | Solubility | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | | Spectrum Type | Description | Splash Key | View |
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| Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive | splash10-0aor-6590000000-d53875d1d1717d638752 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-006y-0290000000-406439b04dab8ae9f72a | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-0603-4970000000-f76480cde6f70f69904f | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-0lk9-9730000000-6885c45bb706a217604b | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-000i-0090000000-ae922ee5b3568def3a2b | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-0a4r-0090000000-bd08abbb2b7066c4796a | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0596-3590000000-59768ae8b64336ff3df0 | Spectrum | | MS | Mass Spectrum (Electron Ionization) | splash10-014i-9300000000-1ee3bddd85e9086b7517 | Spectrum |
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| Toxicity Profile |
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| Route of Exposure | Not Available |
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| Mechanism of Toxicity | Not Available |
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| Metabolism | Not Available |
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| Toxicity Values | Not Available |
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| Lethal Dose | Not Available |
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| Carcinogenicity (IARC Classification) | Not Available |
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| Uses/Sources | Not Available |
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| Minimum Risk Level | Not Available |
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| Health Effects | Not Available |
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| Symptoms | Not Available |
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| Treatment | Not Available |
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| Concentrations |
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| Not Available |
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| External Links |
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| DrugBank ID | Not Available |
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| HMDB ID | HMDB0174135 |
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| FooDB ID | FDB001528 |
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| Phenol Explorer ID | Not Available |
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| KNApSAcK ID | C00003428 |
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| BiGG ID | Not Available |
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| BioCyc ID | CPD-9087 |
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| METLIN ID | Not Available |
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| PDB ID | Not Available |
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| Wikipedia Link | Geranylgeraniol |
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| Chemspider ID | Not Available |
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| ChEBI ID | 46762 |
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| PubChem Compound ID | 5281365 |
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| Kegg Compound ID | C09094 |
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| YMDB ID | Not Available |
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| ECMDB ID | Not Available |
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| References |
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| Synthesis Reference | Not Available |
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| MSDS | Not Available |
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| General References | Not Available |
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