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rac 1,2-Dioleoyl-3-chloropropanediol-d5

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For Research Use Only | Not For Clinical Use
CATAPS1246833000
CAS1246833-00-0
Structure
Synonyms3-Chloro-1,2-propanediol Dioleate D5 (3-Chloro-1,2-propandiol D5)
IUPAC Name[3-chloro-1,1,2,3,3-pentadeuterio-2-[(Z)-octadec-9-enoyl]oxypropyl] (Z)-octadec-9-enoate
Molecular Weight644.46
Molecular FormulaC392H5H66ClO4
Canonical SMILES[2H]C([2H])(Cl)C([2H])(OC(=O)CCCCCCC\C=C/CCCCCCCC)C([2H])([2H])OC(=O)CCCCCCC\C=C/CCCCCCCC
InChIInChI=1S/C39H71ClO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37H,3-16,21-36H2,1-2H3/b19-17-,20-18-/i35D2,36D2,37D
Accurate Mass643.5355
FormatNeat
SubcategoryBiosynthetic compounds, Stable isotope labelled compounds
TypeStable Isotope Labelled
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