3-octadecoxycarbonyl-2-(2-octadecoxy-2-oxidanylidene-ethyl)-2-oxidanyl-heptanoic acid

Systemtic Name: 3-octadecoxycarbonyl-2-(2-octadecoxy-2-oxidanylidene-ethyl)-2-oxidanyl-heptanoic acid Openeye Name: 2-hydroxy-3-octadecoxycarbonyl-2-(2-octadecoxy-2-oxo-ethyl)heptanoic acid CAS Name: 2-hydroxy-2-(2-octadecoxy-2-oxoethyl)-3-[octadecoxy(oxo)methyl]heptanoic acid IUPAC Name: 2-hydroxy-3-octadecoxycarbonyl-2-(2-octadecoxy-2-oxoethyl)heptanoic acid Traditional Name: 2-hydroxy-2-(2-keto-2-stearyloxy-ethyl)-3-stearyloxycarbonyl-enanthic acid Formula: C46H88O7 MolecularWeight: 753.18672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CC(C(CCCC)C(=O)OCCCCCCCCCCCCCCCCCC)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CC(C(CCCC)C(=O)OCCCCCCCCCCCCCCCCCC)(C(=O)O)O

InChI

InChI=1S/C46H88O7/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-52-43(47)41-46(51,45(49)50)42(38-9-6-3)44(48)53-40-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h42,51H,4-41H2,1-3H3,(H,49,50)