
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 100940-55-4 |
| Catalog No. | 2A-9049776 |
| Chinese Name | 雌三醇三硫酸酯三钠盐 |
| Synonyms | Estra-1,3,5[10]-triene-3,16,17-triol Tris(hydrogensulfate) Trisodium Salt; Estriol Trisulfate Trisodium Salt |
| Molecular Formula | C18H21Na3O12S3 |
| Molecular Weight | 594.51600 |
| Purity | 98.00 |
| PubChem ID | 162262404 |
| SMILES | CC12CCC3c4ccc(OS(=O)(=O)[O-])cc4CCC3C1CC(OS(=O)(=O)[O-])C2OS(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChI | InChI=1S/C18H24O12S3.3Na/c1-18-7-6-13-12-5-3-11(28-31(19,20)21)8-10(12)2-4-14(13)15(18)9-16(29-32(22,23)24)17(18)30-33(25,26)27;;;/h3,5,8,13-17H,2,4,6-7,9H2,1H3,(H,19,20,21)(H,22,23,24)(H,25,26,27);;;/q;3*+1/p-3/t13-,14-,15+,16-,17+,18+;;;/m1.../s1 |
| InChI Key | ACUPNXAJMLSZES-NXOIHXQRSA-K |
| Transport Info | Product name: Estriol sodium trisulfate trisodium salt |
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