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Details

Stereochemistry EPIMERIC
Molecular Formula C23H31Cl3O4
Molecular Weight 477.849
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLOXOTESTOSTERONE ACETATE

SMILES

[H][C@@]12CC[C@H](OC(OC(C)=O)C(Cl)(Cl)Cl)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=SJWGVEPLFJGWNB-UWSXKFMVSA-N
InChI=1S/C23H31Cl3O4/c1-13(27)29-20(23(24,25)26)30-19-7-6-17-16-5-4-14-12-15(28)8-10-21(14,2)18(16)9-11-22(17,19)3/h12,16-20H,4-11H2,1-3H3/t16-,17-,18-,19-,20?,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H31Cl3O4
Molecular Weight 477.849
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 6 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
2X9YIP66ZO
Record Status Validated (UNII)
Record Version