(6alpha)-3-Methoxyestra-1,3,5(10)-trien-6-ol hydrogen sulfate compd. with pyridine (1:1)
[CAS# 134223-97-5]

Identification

• Name: (6alpha)-3-Methoxyestra-1,3,5(10)-trien-6-ol hydrogen sulfate compd. with pyridine (1:1)
• Synonyms: Estra-1,3,5(10)-Trien-6-Ol, 3-Methoxy-, Hydrogen Sulfate, (6Alpha)-, Compd. With Pyridine (1:1); Pmts; Pyridinium 3-Methoxyestra-1,3,5(10)-Trien-6-Yl Sulfate
• Molecular Formula: C₂₄H₃₁NO₅S
• Molecular Weight: 445.57
• CAS Registry Number: 134223-97-5
• SMILES: [C@]34(C(C1C(C2=C(C(O[S]([O-])(=O)=O)C1)C=C(OC)C=C2)CC3)CCC4)C.C5=[NH+]C=CC=C5
• InChI: 1S/C19H26O5S.C5H5N/c1-19-8-3-4-17(19)15-11-18(24-25(20,21)22)16-10-12(23-2)5-6-13(16)14(15)7-9-19;1-2-4-6-5-3-1/h5-6,10,14-15,17-18H,3-4,7-9,11H2,1-2H3,(H,20,21,22);1-5H/t14?,15?,17?,18?,19-;/m0./s1
• InChIKey: YHPPWIAASWYKDY-SHJJMTSZSA-N