| 名称 | 内容 |
|---|---|
| kegg编号 | C19278 |
| pubchemid | 124489950 |
| name | N-Nitrosodiethanolamine |
| formula | C4H10N2O3 |
| structure |  |
| Isomeric_Smiles | CCCCC[C@@H](/C=C/[C@H]1[C@H]([C@@H](CC1=O)O)CCCCCCC(=O)O)O |
| Cannoical_Smiles | CCCCCC(C=CC1C(C(CC1=O)O)CCCCCCC(=O)O)O |
| Gotenzyme_Smiles | O=NN(CCO)CCO |
