(Q27263104)

SCHEMBL17510372 (English)

14 October 2016

chemical formula

C₂₂H₃₈O₅

1 reference

SCHEMBL17510372 (English)

14 October 2016

canonical SMILES

CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)OC)O)O

1 reference

SCHEMBL17510372 (English)

14 October 2016

isomeric SMILES

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

1 reference

SCHEMBL17510372 (English)

InChI=1S/C22H38O5/c1-4-5-14-22(2,26)15-10-12-18-17(19(23)16-20(18)24)11-8-6-7-9-13-21(25)27-3/h10,12,17-18,20,24,26H,4-9,11,13-16H2,1-3H3/b12-10+/t17-,18+,20-,22?/m1/s1

14 October 2016

Identifiers

InChI

1 reference

SCHEMBL17510372 (English)

OJLOPKGSLYJEMD-VSEFTTKASA-N

14 October 2016

InChIKey

1 reference

SCHEMBL17510372 (English)

14 October 2016

1 reference

Methyl (11alpha,12alpha,13E)-11,16-dihydroxy-16-methyl-9-oxoprost-13-en-1-oate (English)

14 October 2016

1 reference

Global Substance Registration System

SCHEMBL17510372 (English)

14 October 2016

1 reference

1 reference

UNII

5ZIA0384U5

12-epimisoprostol (English)