Estr-5-en-18-oic acid, 3,3:17,17-bis[1,2-ethanediylbis(oxy)]-11-hydroxy-, gamma-lactone, (11beta)-

Base Information

• Chemical Name: Estr-5-en-18-oic acid, 3,3:17,17-bis[1,2-ethanediylbis(oxy)]-11-hydroxy-, gamma-lactone, (11beta)-
• CAS No.: 59860-72-9
• Molecular Formula: C₂₂H₂₈O₆
• Molecular Weight: 388.461
• European Community (EC) Number: 611-905-0
• DSSTox Substance ID: DTXSID101121028

Synonyms:DTXSID101121028;59860-72-9;Estr-5-en-18-oic acid, 3,3:17,17-bis[1,2-ethanediylbis(oxy)]-11-hydroxy-, gamma-lactone, (11beta)-

Chemical Property of Estr-5-en-18-oic acid, 3,3:17,17-bis[1,2-ethanediylbis(oxy)]-11-hydroxy-, gamma-lactone, (11beta)-

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 388.18858861
• Heavy Atom Count: 28
• Complexity: 748

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MSDS Files:

Useful:

• Canonical SMILES: C1CC2(CC3=CCC4C5CCC6(C57CC(C4C31)OC7=O)OCCO6)OCCO2
• Isomeric SMILES: C1CC2(CC3=CC[C@H]4[C@@H]5CCC6([C@@]57C[C@@H]([C@@H]4[C@H]31)OC7=O)OCCO6)OCCO2

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