Estradiol-3-Sulfate
[CAS# 481-96-9]

Identification

• Name: Estradiol-3-Sulfate
• Synonyms: Aids-156709; 17Beta-Estradiol 3-Sulfate; 17Beta-Hydroxyestra-1,3,5(10)-Trien-3-Yl Hydrogen Sulfate
• Molecular Formula: C₁₈H₂₄O₅S
• Molecular Weight: 352.44
• CAS Registry Number: 481-96-9
• SMILES: [C@H]24[C@H]1[C@@]([C@@H](O)CC1)(CC[C@@H]2C3=CC=C(O[S](=O)(=O)O)C=C3CC4)C
• InChI: 1S/C18H24O5S/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/h3,5,10,14-17,19H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,17+,18+/m1/s1
• InChIKey: QZIGLSSUDXBTLJ-ZBRFXRBCSA-N

Properties

• Density: 1.354g/cm³ (Cal.)