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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H27FO4
Molecular Weight 374.4458
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [BETAMETHASONE-.DELTA.17,20 21-ALDEHYDE]

SMILES

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

InChI

InChIKey=TYYMPHSFTLTHRI-NIQJDLCESA-N
InChI=1S/C22H27FO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-21(13,3)22(15,23)18(27)10-20(16,2)19(12)17(26)11-24/h6-7,9,11-12,15-16,18,26-27H,4-5,8,10H2,1-3H3/b19-17-/t12-,15-,16-,18-,20-,21-,22-/m0/s1

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Approval Year