(5Z,8Z,10E,12E)-13-[(2S,3S)-3-Pentyl-2-oxiranyl]-5,8,10,12-tridecatetraenoic acid

CAS Registry Number®

81918-96-9

CAS Name

(5Z,8Z,10E,12E)-13-[(2S,3S)-3-Pentyl-2-oxiranyl]-5,8,10,12-tridecatetraenoic acid

Molecular Formula

C20H30O3

Molecular Mass

318.45

Cite this Page

(5Z,8Z,10E,12E)-13-[(2S,3S)-3-Pentyl-2-oxiranyl]-5,8,10,12-tridecatetraenoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81918-96-9 (retrieved 2024-11-24) (CAS RN: 81918-96-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H30O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h4,6-10,13,16,18-19H,2-3,5,11-12,14-15,17H2,1H3,(H,21,22)/b6-4-,9-7-,10-8+,16-13+/t18-,19-/m0/s1

InChIKey

InChIKey=URDQSJSEGRMOIT-FDMWOPBLSA-N

SMILES

C(=C/C=C/C=C\C/C=C\CCCC(O)=O)\[C@H]1[C@H](CCCCC)O1

Canonical SMILES

O=C(O)CCCC=CCC=CC=CC=CC1OC1CCCCC

Other Names for this Substance

  • 5,8,10,12-Tridecatetraenoic acid, 13-[(2S,3S)-3-pentyl-2-oxiranyl]-, (5Z,8Z,10E,12E)-
  • 5,8,10,12-Tridecatetraenoic acid, 13-(3-pentyloxiranyl)-, [2S-[2α(5Z,8Z,10E,12E),3β]]-
  • 5,8,10,12-Tridecatetraenoic acid, 13-[(2S,3S)-3-pentyloxiranyl]-, (5Z,8Z,10E,12E)-
  • (5Z,8Z,10E,12E)-13-[(2S,3S)-3-Pentyl-2-oxiranyl]-5,8,10,12-tridecatetraenoic acid
  • Eoxin A4

CAS INSIGHTSTM
Hourglass and a clock