(E)-5-methoxy-2-[(E)-5-methoxy-1-oxidanyl-henicos-7-en-2-yl]oxyperoxy-henicos-7-en-1-ol

Systemtic Name: (E)-5-methoxy-2-[(E)-5-methoxy-1-oxidanyl-henicos-7-en-2-yl]oxyperoxy-henicos-7-en-1-ol Openeye Name: (E)-2-[(E)-1-(hydroxymethyl)-4-methoxy-icos-6-enoxy]peroxy-5-methoxy-henicos-7-en-1-ol CAS Name: (E)-2-[(E)-1-hydroxy-5-methoxyheneicos-7-en-2-yl]oxydioxy-5-methoxy-7-heneicosen-1-ol IUPAC Name: (E)-2-[(E)-1-hydroxy-5-methoxyhenicos-7-en-2-yl]oxyperoxy-5-methoxyhenicos-7-en-1-ol Traditional Name: (E)-5-methoxy-2-[(E)-4-methoxy-1-methylol-eicos-6-enoxy]peroxy-heneicos-7-en-1-ol Formula: C44H86O7 MolecularWeight: 727.14944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CCC(CCC(CO)OOOC(CCC(CC=CCCCCCCCCCCCCC)OC)CO)OC

Isomeric SMILES

CCCCCCCCCCCCC/C=C/CC(OC)CCC(OOOC(CO)CCC(OC)C/C=C/CCCCCCCCCCCCC)CO

InChI

InChI=1S/C44H86O7/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(47-3)35-37-43(39-45)49-51-50-44(40-46)38-36-42(48-4)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h29-32,41-46H,5-28,33-40H2,1-4H3/b31-29+,32-30+