geranyl acetate
(HIGQPQRQIQDZMP-DHZHZOJOSA-N)
Structure
- SMILES
- C/C(=C\COC(=O)C)/CCC=C(C)C
- Molecular Formula:
- C12H20O2
- Molecular Weight:
- 196.286
- Log P:
- 3.2422
- Hydrogen Bond Acceptor:
- 2
- Hydrogen Bond Donor:
- 0
- TPSA:
- 26.3
- CAS Number(s):
- 105-87-3; 8022-83-1; 16409-44-2; 33843-18-4; 68311-13-7
Synonym(s)
1.
geranyl acetate
2.
geraniol acetate
3.
geraniol acetate, (E)-isomer
4.
geraniol acetate, (Z)-isomer
5.
nerol acetate
6.
neryl acetate
External Link(s)
| MeSH | C432872 |
| PubChem Compound | 1549026 |
| BindingDB | 50037025 |
| ChEBI | 5331 88568 |
| CHEMBL | CHEMBL1369384 |
| KEGG | cpd:C09861 |
| ZINC | 1531610 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Chromosome Breakage | 29745075 | CTD | |
| 2 | Nociceptive Pain | 23724298 | CTD |
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