5,6-Epoxy-13-cis Retinoic Acid

Analyte Name

5,6-Epoxy-13-cis Retinoic Acid

CAS Number

81444-57-7

Molecular Formula

C20 H28 O3

Molecular Weight

316.43

Accurate Mass

316.2038

SMILES

C\C(=C\C(=O)O)\C=C\C=C(/C)\C=C\[C@]12O[C@@]1(C)CCCC2(C)C

InChI

InChI=1S/C20H28O3/c1-15(8-6-9-16(2)14-17(21)22)10-13-20-18(3,4)11-7-12-19(20,5)23-20/h6,8-10,13-14H,7,11-12H2,1-5H3,(H,21,22)/b9-6+,13-10+,15-8+,16-14-/t19-,20+/m0/s1

IUPAC

(2Z,4E,6E,8E)-3,7-dimethyl-9-[(1S,6R)-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl]nona-2,4,6,8-tetraenoic acid

Storage Temperature

-20°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Isotretinoin; Tretinoin