Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 9,12,15-Octadecatrienoic acid, 1,2-dimethyl-1,2-ethanediyl ester
RN: 84006-24-6
InChIKey: GUBLMNXUBABCAN-LCTBMWLOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C40-H66-O4

Molecular Weight

  • 610.9574
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 1,2-Dimethyl-1,2-ethanediyl 9,12,15-octadecatrienoate
  • 2,3-Butanediol bis(9,12,15-octadecatrienoate)

Systematic Name

  • 9,12,15-Octadecatrienoic acid, 1,2-dimethyl-1,2-ethanediyl ester

Registry Numbers

CAS Registry Number

  • 84006-24-6

System Generated Number

  • 0084006246

Structure Descriptors

InChI

1S/C40H66O4/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39(41)43-37(3)38(4)44-40(42)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h7-10,13-16,19-22,37-38H,5-6,11-12,17-18,23-36H2,1-4H3/b9-7+,10-8+,15-13+,16-14+,21-19+,22-20+

InChIKey

GUBLMNXUBABCAN-LCTBMWLOSA-N

Smiles

CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)OC(C(OC(=O)CCCCCCC/C=C/C/C=C/C/C=C/CC)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0056189,