
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 19041-09-9 |
| Catalog No. | 2A-1186331 |
| Chinese Name | Gluconapin |
| Synonyms | Gluconapin; 3-butenyl-glucosinolate; but-3-enyl glucosinolate |
| Molecular Formula | C11H19NO9S2 |
| Molecular Weight | 411.49 |
| Purity | 98.00 |
| PubChem ID | 29193128 |
| SMILES | C=CCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1O |
| InChI | InChI=1S/C11H19NO9S2/c1-2-3-4-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(5-13)20-11/h2,6,8-11,13-16H,1,3-5H2,(H,17,18,19)/p-1/b12-7+/t6-,8-,9+,10-,11+/m1/s1 |
| InChI Key | PLYQBXHVYUJNQB-BZVDQRPCSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
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