Estriol Succinate
[CAS# 514-68-1]

Identification

• Name: Estriol Succinate
• Synonyms: Disodium 4-[[(8R,9S,13S,14S,16R,17R)-3-Hydroxy-13-Methyl-16-(4-Oxido-4-Oxo-Butanoyl)Oxy-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl]Oxy]-4-Oxo-Butanoate; Disodium 4-[[(8R,9S,13S,14S,16R,17R)-3-Hydroxy-13-Methyl-16-(4-Oxido-1,4-Dioxobutoxy)-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl]Oxy]-4-Oxobutanoate; Disodium 4-[[(8R,9S,13S,14S,16R,17R)-3-Hydroxy-16-(4-Keto-4-Oxido-Butanoyl)Oxy-13-Methyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl]Oxy]-4-Keto-Butyrate
• Molecular Formula: C₂₆H₃₀Na₂O₉
• Molecular Weight: 532.50
• CAS Registry Number: 514-68-1
• EINECS: 208-185-1
• SMILES: [C@H]34[C@H]2[C@@H](C1=CC=C(O)C=C1CC2)CC[C@@]3([C@@H](OC(=O)CCC([O-])=O)[C@H](OC(=O)CCC([O-])=O)C4)C.[Na+].[Na+]
• InChI: 1S/C26H32O9.2Na/c1-26-11-10-17-16-5-3-15(27)12-14(16)2-4-18(17)19(26)13-20(34-23(32)8-6-21(28)29)25(26)35-24(33)9-7-22(30)31;;/h3,5,12,17-20,25,27H,2,4,6-11,13H2,1H3,(H,28,29)(H,30,31);;/q;2*+1/p-2/t17-,18-,19+,20-,25+,26+;;/m1../s1
• InChIKey: WHMFJWUAHROXHB-KQAQVGESSA-L

Properties

• Boiling point: 716.8°C at 760 mmHg (Cal.)
• Flash point: 240.5°C (Cal.)