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2-hexadecylicosanedioic acid

2-hexadecylicosanedioic acid

Systemtic Name:2-hexadecylicosanedioic acid
Openeye Name:2-hexadecylicosanedioic acid
CAS Name:2-hexadecyleicosanedioic acid
IUPAC Name:2-hexadecylicosanedioic acid
Traditional Name:2-cetyleicosanedioic acid
Formula: C36H70O4
MolecularWeight: 566.9386
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC(=O)O)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC(=O)O)C(=O)O


InChI

InChI=1S/C36H70O4/c1-2-3-4-5-6-7-8-9-13-16-19-22-25-28-31-34(36(39)40)32-29-26-23-20-17-14-11-10-12-15-18-21-24-27-30-33-35(37)38/h34H,2-33H2,1H3,(H,37,38)(H,39,40)


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