EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H19NO6 |
| Net Charge | 0 |
| Average Mass | 345.351 |
| Monoisotopic Mass | 345.12124 |
| SMILES | CCOC(=O)CNC(=O)c1cc(-c2ccc3c(c2)OCCO3)oc1C |
| InChI | InChI=1S/C18H19NO6/c1-3-22-17(20)10-19-18(21)13-9-15(25-11(13)2)12-4-5-14-16(8-12)24-7-6-23-14/h4-5,8-9H,3,6-7,10H2,1-2H3,(H,19,21) |
| InChIKey | HOSWDHAYFAMUHG-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) |
| 2-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-furanyl]-oxomethyl]amino]acetic acid ethyl ester (CHEBI:114634) is a N-acyl-amino acid (CHEBI:51569) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26096 | LINCS |