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3BETA-ACETOXY-16ALPHA-[2(2-ACETOXY ETHOXY)-ETHOXY]-PREGN-5-EN-20-ONE
FEATURES
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NAMES
  • 3BETA-ACETOXY-16ALPHA-[2(2-ACETOXY ETHOXY)-ETHOXY]-PREGN-5-EN-20-ONE
SMILES
CC(=O)OCCOCCO[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1C(C)=O
InChI
InChI=1S/C29H44O7/c1-18(30)27-26(35-15-13-33-12-14-34-19(2)31)17-25-23-7-6-21-16-22(36-20(3)32)8-10-28(21,4)24(23)9-11-29(25,27)5/h6,22-27H,7-17H2,1-5H3/t22-,23+,24-,25-,26+,27-,28-,29-/m0/s1
MOLECULAR FORMULA
C29H44O7
CROSS REFERENCES
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3BETA-ACETOXY-16ALPHA-[2(2-ACETOXY ETHOXY)-ETHOXY]-PREGN-5-EN-20-ONE

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 504.31
AlogP 4.66
HBond donors 0
HBond acceptors 7
Atoms 80
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 3BETA-ACETOXY-16ALPHA-[2(2-ACETOXY ETHOXY)-ETHOXY]-PREGN-5-EN-20-ONE.