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3-hexadecanoyloxy-15-methyl-hexadecanoic acid

3-hexadecanoyloxy-15-methyl-hexadecanoic acid

Systemtic Name:3-hexadecanoyloxy-15-methyl-hexadecanoic acid
Openeye Name:3-hexadecanoyloxy-15-methyl-hexadecanoic acid
CAS Name:15-methyl-3-(1-oxohexadecoxy)hexadecanoic acid
IUPAC Name:3-hexadecanoyloxy-15-methylhexadecanoic acid
Traditional Name:3-hexadecanoyloxy-15-methyl-palmitic acid
Formula: C33H64O4
MolecularWeight: 524.85886
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCC(C)C)CC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCC(C)C)CC(=O)O


InChI

InChI=1S/C33H64O4/c1-4-5-6-7-8-9-10-11-12-16-19-22-25-28-33(36)37-31(29-32(34)35)27-24-21-18-15-13-14-17-20-23-26-30(2)3/h30-31H,4-29H2,1-3H3,(H,34,35)


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