EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H26O5 |
| Net Charge | 0 |
| Average Mass | 346.423 |
| Monoisotopic Mass | 346.17802 |
| SMILES | COc1cc(C(=O)OC2CC3CCC2(C)C3(C)C)ccc1OC(C)=O |
| InChI | InChI=1S/C20H26O5/c1-12(21)24-15-7-6-13(10-16(15)23-5)18(22)25-17-11-14-8-9-20(17,4)19(14,2)3/h6-7,10,14,17H,8-9,11H2,1-5H3 |
| InChIKey | KUGMSYFFXZDRGR-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-acetyloxy-3-methoxybenzoic acid (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) ester (CHEBI:120683) is a methoxybenzoic acid (CHEBI:25238) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32125 | LINCS |