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Details

Stereochemistry EPIMERIC
Molecular Formula C20H27FO5S
Molecular Weight 398.489
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FPL-67336

SMILES

[H][C@@]12CCC([C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]2([H])C[C@@H](O)C4=CC(=O)C=C[C@]34C)S(C)(=O)=O

InChI

InChIKey=OCGVGQWOJKERDH-GCUSKVGZSA-N
InChI=1S/C20H27FO5S/c1-18-10-16(24)20(21)13(12(18)4-5-17(18)27(3,25)26)9-15(23)14-8-11(22)6-7-19(14,20)2/h6-8,12-13,15-17,23-24H,4-5,9-10H2,1-3H3/t12-,13-,15+,16-,17?,18-,19-,20-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
FPL-67336
Code English
TIPREDANE METABOLITE V
Common Name English
ANDROSTA-1,4-DIEN-3-ONE, 9-FLUORO-6,11-DIHYDROXY-17-(METHYLSULFONYL)-, (6.BETA.,11.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
MO9VL2X4EG
Created by admin on Sat Dec 16 16:54:33 GMT 2023 , Edited by admin on Sat Dec 16 16:54:33 GMT 2023
PRIMARY
CAS
183242-26-4
Created by admin on Sat Dec 16 16:54:33 GMT 2023 , Edited by admin on Sat Dec 16 16:54:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID60939701
Created by admin on Sat Dec 16 16:54:33 GMT 2023 , Edited by admin on Sat Dec 16 16:54:33 GMT 2023
PRIMARY
PUBCHEM
183795
Created by admin on Sat Dec 16 16:54:33 GMT 2023 , Edited by admin on Sat Dec 16 16:54:33 GMT 2023
PRIMARY