2-[3,4-bis(oxidanyl)phenyl]-3,5,7-triheptoxy-6-heptyl-chromen-4-one

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-3,5,7-triheptoxy-6-heptyl-chromen-4-one Openeye Name: 2-(3,4-dihydroxyphenyl)-3,5,7-triheptoxy-6-heptyl-chromen-4-one CAS Name: 2-(3,4-dihydroxyphenyl)-3,5,7-triheptoxy-6-heptyl-1-benzopyran-4-one IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-triheptoxy-6-heptylchromen-4-one Traditional Name: 2-(3,4-dihydroxyphenyl)-3,5,7-triheptoxy-6-heptyl-chromone Formula: C43H66O7 MolecularWeight: 694.97994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C=C2C(=C1OCCCCCCC)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)OCCCCCCC)OCCCCCCC

Isomeric SMILES

CCCCCCCC1=C(C=C2C(=C1OCCCCCCC)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)OCCCCCCC)OCCCCCCC

InChI

InChI=1S/C43H66O7/c1-5-9-13-17-21-25-34-37(47-28-22-18-14-10-6-2)32-38-39(42(34)48-29-23-19-15-11-7-3)40(46)43(49-30-24-20-16-12-8-4)41(50-38)33-26-27-35(44)36(45)31-33/h26-27,31-32,44-45H,5-25,28-30H2,1-4H3