EMBL-EBI | Chemical Biology | ChEBI
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| Formula | Na.C16H26N5O8.Ca |
| Net Charge | 0 |
| Average Mass | 479.479 |
| Monoisotopic Mass | 479.13050 |
| SMILES | CNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)NC)CC(=O)[O-])CC(=O)[O-].[Ca+2].[Na+] |
| InChI | InChI=1S/C16H29N5O8.Ca.Na/c1-17-12(22)7-20(10-15(26)27)5-3-19(9-14(24)25)4-6-21(11-16(28)29)8-13(23)18-2;;/h3-11H2,1-2H3,(H,17,22)(H,18,23)(H,24,25)(H,26,27)(H,28,29);;/q;+2;+1/p-3 |
| InChIKey | YOVKQJBQALQTMU-UHFFFAOYSA-K |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| caldiamide sodium (CHEBI:751866) is a amino acid amide (CHEBI:22475) |
| Synonym | Source |
|---|---|
| Caldiamide sodium | ChEMBL |