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Details

Stereochemistry EPIMERIC
Molecular Formula C20H34F2O5
Molecular Weight 392.4778
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (11.ALPHA.)-16,16-DIFLUORO-11,15-DIHYDROXY-9-OXOPROSTAN-1-OIC ACID

SMILES

CCCCC(F)(F)C(O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O

InChI

InChIKey=PNVYHTHOCKTJCO-MWPGWRTMSA-N
InChI=1S/C20H34F2O5/c1-2-3-12-20(21,22)18(25)11-10-15-14(16(23)13-17(15)24)8-6-4-5-7-9-19(26)27/h14-15,17-18,24-25H,2-13H2,1H3,(H,26,27)/t14-,15-,17-,18?/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H34F2O5
Molecular Weight 392.4778
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 00:38:56 GMT 2025
Edited
by admin
on Wed Apr 02 00:38:56 GMT 2025
Record UNII
E6ED27K8BN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LUBIPROSTONE METABOLITE M3
Preferred Name English
(11.ALPHA.)-16,16-DIFLUORO-11,15-DIHYDROXY-9-OXOPROSTAN-1-OIC ACID
Systematic Name English
PROSTAN-1-OIC ACID, 16,16-DIFLUORO-11,15-DIHYDROXY-9-OXO-, (11.ALPHA.)-
Systematic Name English
Code System Code Type Description
PUBCHEM
10271828
Created by admin on Wed Apr 02 00:38:56 GMT 2025 , Edited by admin on Wed Apr 02 00:38:56 GMT 2025
PRIMARY
CAS
475992-30-4
Created by admin on Wed Apr 02 00:38:56 GMT 2025 , Edited by admin on Wed Apr 02 00:38:56 GMT 2025
PRIMARY
FDA UNII
E6ED27K8BN
Created by admin on Wed Apr 02 00:38:56 GMT 2025 , Edited by admin on Wed Apr 02 00:38:56 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE
MAJOR
PLASMA