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Details

Stereochemistry EPIMERIC
Molecular Formula C32H45F5O3S
Molecular Weight 604.755
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Fulvestrant

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C(CCCCCCCCC[S+]([O-])CCCC(F)(F)C(F)(F)F)=CC4=C3C=CC(O)=C4

InChI

InChIKey=NKMFFYOPQZINKX-IGFVOJFVSA-N
InChI=1S/C32H45F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h11-12,20-21,26-29,38-39H,2-10,13-19H2,1H3/t26-,27+,28+,29-,30+,41?/m1/s1

HIDE SMILES / InChI

Molecular Formula C32H45F5O3S
Molecular Weight 604.755
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:29:14 GMT 2025
Edited
by admin
on Mon Mar 31 21:29:14 GMT 2025
Record UNII
52A05VPF7S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-Fulvestrant
Common Name English
Delta-6 Fulvestrant
Preferred Name English
ESTRA-1,3,5(10),6-TETRAENE-3,17-DIOL,7-(9-((4,4,5,5,5-PENTAFLUOROPENTYL)SULFINYL)NONYL)-(7.ALPHA.,17.BETA.)
Common Name English
FULVESTRANT IMPURITY, .DELTA.6,7-FULVESTRANT- [USP IMPURITY]
Common Name English
7-[9-[(4,4,5,5,5-Pentafluoropentyl)sulfinyl]nonyl]estra-1,3,5(10),6-tetraene-3,17?-diol
Systematic Name English
FULVESTRANT IMPURITY E [EP IMPURITY]
Common Name English
Delta-6,7 Fulvestrant
Common Name English
Code System Code Type Description
CAS
2170200-14-1
Created by admin on Mon Mar 31 21:29:14 GMT 2025 , Edited by admin on Mon Mar 31 21:29:14 GMT 2025
PRIMARY
SMS_ID
300000052908
Created by admin on Mon Mar 31 21:29:14 GMT 2025 , Edited by admin on Mon Mar 31 21:29:14 GMT 2025
PRIMARY
FDA UNII
52A05VPF7S
Created by admin on Mon Mar 31 21:29:14 GMT 2025 , Edited by admin on Mon Mar 31 21:29:14 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY