EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H32N2O5 |
| Net Charge | 0 |
| Average Mass | 440.540 |
| Monoisotopic Mass | 440.23112 |
| SMILES | COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2C(=O)C1CCCCC1 |
| InChI | InChI=1S/C25H32N2O5/c1-32-25(31)21-18(14-28)20-13-26-19(12-11-17(24(26)30)15-7-5-6-8-15)22(21)27(20)23(29)16-9-3-2-4-10-16/h7,11-12,16,18,20-22,28H,2-6,8-10,13-14H2,1H3/t18-,20-,21+,22+/m1/s1 |
| InChIKey | FAIHTTLOGWXJOT-YJMBLLCNSA-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) |
| LSM-10238 (CHEBI:98859) is a carboxylic acid (CHEBI:33575) |
| LSM-10238 (CHEBI:98859) is a pyrrolidinecarboxylic acid (CHEBI:46767) |
| Manual Xrefs | Databases |
|---|---|
| LSM-10238 | LINCS |