EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C34H40N4O5 |
| Net Charge | 0 |
| Average Mass | 584.717 |
| Monoisotopic Mass | 584.29987 |
| SMILES | COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(n(C)c3ccccc23)C(=O)N([C@H](C)CO)C[C@@H]1C |
| InChI | InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1 |
| InChIKey | AYMJUORULYIZBX-DDFCPOBKSA-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-30825 (CHEBI:119376) is a indolyl carboxylic acid (CHEBI:46867) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30825 | LINCS |