1,1′,1′′-(1,2,3-Propanetriyl) tri-(13Z)-13-docosenoate

CAS Registry Number®

2752-99-0

CAS Name

1,1′,1′′-(1,2,3-Propanetriyl) tri-(13Z)-13-docosenoate

Molecular Formula

C69H128O6

Molecular Mass

1053.75

Cite this Page

1,1′,1′′-(1,2,3-Propanetriyl) tri-(13Z)-13-docosenoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2752-99-0 (retrieved 2024-11-24) (CAS RN: 2752-99-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    31.5-32 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C69H128O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,66H,4-24,31-65H2,1-3H3/b28-25-,29-26-,30-27-

InChIKey

InChIKey=XDSPGKDYYRNYJI-IUPFWZBJSA-N

SMILES

C(OC(CCCCCCCCCCC/C=C\CCCCCCCC)=O)(COC(CCCCCCCCCCC/C=C\CCCCCCCC)=O)COC(CCCCCCCCCCC/C=C\CCCCCCCC)=O

Canonical SMILES

O=C(OCC(OC(=O)CCCCCCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCCCCCC=CCCCCCCCC)CCCCCCCCCCCC=CCCCCCCCC

Other Names for this Substance

  • 13-Docosenoic acid, 1,1′,1′′-(1,2,3-propanetriyl) ester, (13Z,13′Z,13′′Z)-
  • 13-Docosenoin, tri-, (Z,Z,Z)-
  • 13-Docosenoic acid, 1,2,3-propanetriyl ester, (Z,Z,Z)-
  • Erucin, tri-
  • 13-Docosenoic acid, 1,2,3-propanetriyl ester, (13Z,13′Z,13′′Z)-

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