(17alpha)-Estra-1,3,5(10)-Triene-3,17-Diol 3-(Hydrogen Sulfate) Monosodium Salt
[CAS# 56050-04-5]

Identification

• Name: (17alpha)-Estra-1,3,5(10)-Triene-3,17-Diol 3-(Hydrogen Sulfate) Monosodium Salt
• Synonyms: Sodium (13S,17R)-13-Methyl-3-Sulfoxy-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Olate; Estra-1,3,5(10)-Triene-3,17-Diol, 3-(Hydrogen Sulfate), Monosodiumsalt, (17Alpha)-
• Molecular Formula: C₁₈H₂₃NaO₅S
• Molecular Weight: 374.43
• CAS Registry Number: 56050-04-5
• EINECS: 259-966-9
• SMILES: [C@]34(C(C1C(C2=C(CC1)C=C(O[S](=O)(=O)O)C=C2)CC3)CC[C@H]4[O-])C.[Na+]
• InChI: 1S/C18H23O5S.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;/h3,5,10,14-17H,2,4,6-9H2,1H3,(H,20,21,22);/q-1;+1/t14?,15?,16?,17-,18+;/m1./s1
• InChIKey: DKMFGZCZSXTERZ-QEOOSNJHSA-N