Showing Metabocard for (S)-2,3,4,5-tetrahydrodipicolinate (BASm0000766)
| Common Name | (s)-2,3,4,5-tetrahydrodipicolinate |
|---|---|
| Description | Tetrahydrodipicolinate is expected to be in Cannabis as all living plants are known to produce and metabolize it. |
| Structure | |
| Molecular Formula | C7H9NO4 |
| Average Mass | 171.15000 |
| Monoisotopic Mass | 171.05320 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | 4226-22-6 |
| SMILES | O=C([O-])C1=N[C@H](C(=O)[O-])CCC1 |
| InChI Identifier | InChI=1S/C7H9NO4/c9-6(10)4-2-1-3-5(8-4)7(11)12/h4H,1-3H2,(H,9,10)(H,11,12)/t4-/m0/s1 |
| InChI Key | CXMBCXQHOXUCEO-BYPYZUCNSA-N |
| CHEBI ID | CHEBI:16845 |
| State | 1 |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |