
| CAS Number | 61612-83-7 |
| Catalog Number | AG00EEO5(AGN-PC-0T11BV) |
| Chemical Name | ,9-Dehydroestrone 3-Sulfate Sodium Salt |
| IUPAC Name | sodium;[(13S,14S)-13-methyl-17-oxo-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate |
| InChI | InChI=1S/C18H20O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3,5,10,16H,2,4,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t16-,18-;/m0./s1 |
| InChI Key | LLUMKBPKZHXWDL-AKXYIILFSA-M |
| MDL Number | MFCD11114043 |
| Molecular Formula | C18H19NaO5S |
| Molecular Weight | 370.3952 |
| SMILES | [Na+].C[C@]12CCC3=C(CCc4cc(OS(=O)(=O)[O-])ccc34)[C@@H]1CCC2=O |
| UNII | B825F101CJ |
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