Structural formula of 1,3-Diolein-D66

1,3-Diolein-D66

Product number: 72-1866
CAS number: 2692624-33-0
Synonyms: 1,1′-(2-Hydroxy-1,3-propanediyl) di-(9Z)-9-octadecenoate-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-d33

Identifiers

CAS Index Name: 9-Octadecenoic-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-d33 acid, 1,1′-(2-hydroxy-1,3-propanediyl) ester, (9Z,9′Z)-
Molecular formula: C39H6D66O5
Molecular weight: 687.39
Smiles: O=C(OCC(O)COC(=O)CCCCCCCC=CCCCCCCCC)CCCCCCCC=CCCCCCCCC
Isomeric Smiles: C(C(COC(C(C(C(C(C(C(C(/C(=C(\C(C(C(C(C(C(C(C([2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])/[2H])/[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])=O)O)OC(C(C(C(C(C(C(C(/C(=C(\C(C(C(C(C(C(C(C([2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])/[2H])/[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])=O
InChI: InChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,40H,3-16,21-36H2,1-2H3/b19-17-,20-18-/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D,18D,19D,20D,21D2,22D2,23D2,24D2,25D2,26D2,27D2,28D2,29D2,30D2,31D2,32D2,33D2,34D2
InChIKey: InChIKey=DRAWQKGUORNASA-LJTHRZGISA-N

Product information

Purity: >99%
Storage: Freezer
Supplied as: Neat
Physical state: Liquid
Documentation: Certificate of Analysis
MSDS: Ask for MSDS

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72-1866-71,3-Diolein-D66 - 25 mg230.00