7-(9-((9-((4,4,5,5,5-pentafluoropentyl)sulfinyl)nonyl)sulfinyl)nonyl)estra-1,3,5(10)-triene-3,17β-diol (Q27285740)

Fulvestrant Impurity C (English)

14 October 2016

chemical formula

C₄₁H₆₅F₅O₄S₂

1 reference

Fulvestrant Impurity C (English)

14 October 2016

canonical SMILES

CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F

1 reference

Fulvestrant Impurity C (English)

14 October 2016

isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F

1 reference

Fulvestrant Impurity C (English)

InChI=1S/C41H65F5O4S2/c1-39-24-22-35-34-19-18-33(47)30-32(34)29-31(38(35)36(39)20-21-37(39)48)17-12-8-4-2-5-9-13-25-51(49)26-14-10-6-3-7-11-15-27-52(50)28-16-23-40(42,43)41(44,45)46/h18-19,30-31,35-38,47-48H,2-17,20-29H2,1H3/t31?,35-,36+,37+,38-,39+,51?,52?/m1/s1

14 October 2016

Identifiers

InChI

1 reference

Fulvestrant Impurity C (English)

LIYGRWMJKJPHDO-OJKKUXCPSA-N

14 October 2016

InChIKey

1 reference

Fulvestrant Impurity C (English)

14 October 2016

1 reference

(17beta)-7-[9-({9-[(4,4,5,5,5-Pentafluoropentyl)sulfinyl]nonyl}sulfinyl)nonyl]estra-1,3,5(10)-triene-3,17-diol (English)

14 October 2016

2 references

Fulvestrant Impurity C (English)

matched by identifier from

14 October 2016

InChIKey

LIYGRWMJKJPHDO-OJKKUXCPSA-N

1 reference

2 references

Global Substance Registration System

UNII

OMU8ZM6O3U