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22-(3,4-dimethoxy-6-methyl-2-oxidanyl-phenyl)docosanoic acid

22-(3,4-dimethoxy-6-methyl-2-oxidanyl-phenyl)docosanoic acid

Systemtic Name:22-(3,4-dimethoxy-6-methyl-2-oxidanyl-phenyl)docosanoic acid
Openeye Name:22-(2-hydroxy-3,4-dimethoxy-6-methyl-phenyl)docosanoic acid
CAS Name:22-(2-hydroxy-3,4-dimethoxy-6-methylphenyl)docosanoic acid
IUPAC Name:22-(2-hydroxy-3,4-dimethoxy-6-methylphenyl)docosanoic acid
Traditional Name:22-(2-hydroxy-3,4-dimethoxy-6-methyl-phenyl)behenic acid
Formula: C31H54O5
MolecularWeight: 506.75746
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CCCCCCCCCCCCCCCCCCCCCC(=O)O)O)OC)OC


Isomeric SMILES

CC1=CC(=C(C(=C1CCCCCCCCCCCCCCCCCCCCCC(=O)O)O)OC)OC


InChI

InChI=1S/C31H54O5/c1-26-25-28(35-2)31(36-3)30(34)27(26)23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-29(32)33/h25,34H,4-24H2,1-3H3,(H,32,33)


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