mespirenone (Q25091763)

Mespirenone (English)

18 November 2016

chemical formula

C₂₅H₃₀O₄S

1 reference

Mespirenone (English)

18 November 2016

canonical SMILES

CC(=O)SC1CC2=CC(=O)C=CC2(C3C1C4C5CC5C6(C4(CC3)C)CCC(=O)O6)C

1 reference

Mespirenone (English)

18 November 2016

isomeric SMILES

CC(=O)S[C@@H]1CC2=CC(=O)C=C[C@@]2([C@@H]3[C@@H]1[C@@H]4[C@@H]5C[C@@H]5[C@]6([C@]4(CC3)C)CCC(=O)O6)C

1 reference

Mespirenone (English)

InChI=1S/C25H30O4S/c1-13(26)30-19-11-14-10-15(27)4-7-23(14,2)17-5-8-24(3)22(21(17)19)16-12-18(16)25(24)9-6-20(28)29-25/h4,7,10,16-19,21-22H,5-6,8-9,11-12H2,1-3H3/t16-,17+,18+,19-,21+,22+,23+,24+,25+/m1/s1

18 November 2016

Identifiers

InChI

1 reference

Mespirenone (English)

CPHJTSJQUQZOLJ-ISIDMKFXSA-N

18 November 2016

InChIKey

1 reference

Global Substance Registration System

Mespirenone (English)

18 November 2016

1 reference

UNII

E91TME2I23

mespirenone (English)

18 November 2016

1 reference

Mespirenone [INN] (English)

18 November 2016

1 reference

Mespirenone (English)

18 November 2016

1 reference

Global Substance Registration System

MESPIRENONE (English)

18 November 2016

1 reference

1 reference

UNII

E91TME2I23

mespirenone (English)