15-oxidanyl-14-tridecyl-nonacosane-13,14,15-tricarboxylic acid

Systemtic Name: 15-oxidanyl-14-tridecyl-nonacosane-13,14,15-tricarboxylic acid Openeye Name: 15-hydroxy-14-tridecyl-nonacosane-13,14,15-tricarboxylic acid CAS Name: 15-hydroxy-14-tridecylnonacosane-13,14,15-tricarboxylic acid IUPAC Name: 15-hydroxy-14-tridecylnonacosane-13,14,15-tricarboxylic acid Traditional Name: 15-hydroxy-14-tridecyl-nonacosane-13,14,15-tricarboxylic acid Formula: C45H86O7 MolecularWeight: 739.16014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(=O)O)C(C(=O)O)(C(CCCCCCCCCCCCC)(CCCCCCCCCCCCC)C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCC(C(=O)O)C(C(=O)O)(C(CCCCCCCCCCCCC)(CCCCCCCCCCCCC)C(=O)O)O

InChI

InChI=1S/C45H86O7/c1-4-7-10-13-16-19-22-25-28-31-34-37-40(41(46)47)45(52,43(50)51)44(42(48)49,38-35-32-29-26-23-20-17-14-11-8-5-2)39-36-33-30-27-24-21-18-15-12-9-6-3/h40,52H,4-39H2,1-3H3,(H,46,47)(H,48,49)(H,50,51)