3-ethoxy-6,8-bis(oxidanyl)-5-(6-oxidanyl-1-oxidanylidene-3-pentyl-isochromen-8-yl)oxy-3-pentyl-4H-isochromen-1-one

Systemtic Name: 3-ethoxy-6,8-bis(oxidanyl)-5-(6-oxidanyl-1-oxidanylidene-3-pentyl-isochromen-8-yl)oxy-3-pentyl-4H-isochromen-1-one Openeye Name: 3-ethoxy-6,8-dihydroxy-5-(6-hydroxy-1-oxo-3-pentyl-isochromen-8-yl)oxy-3-pentyl-isochroman-1-one CAS Name: 3-ethoxy-6,8-dihydroxy-5-[(6-hydroxy-1-oxo-3-pentyl-2-benzopyran-8-yl)oxy]-3-pentyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-ethoxy-6,8-dihydroxy-5-(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy-3-pentyl-4H-isochromen-1-one Traditional Name: 3-amyl-5-(3-amyl-6-hydroxy-1-keto-isochromen-8-yl)oxy-3-ethoxy-6,8-dihydroxy-isochroman-1-one Formula: C30H36O9 MolecularWeight: 540.60144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=CC(=CC(=C2C(=O)O1)OC3=C(C=C(C4=C3CC(OC4=O)(CCCCC)OCC)O)O)O

Isomeric SMILES

CCCCCC1=CC2=CC(=CC(=C2C(=O)O1)OC3=C(C=C(C4=C3CC(OC4=O)(CCCCC)OCC)O)O)O

InChI

InChI=1S/C30H36O9/c1-4-7-9-11-20-14-18-13-19(31)15-24(25(18)28(34)37-20)38-27-21-17-30(36-6-3,12-10-8-5-2)39-29(35)26(21)22(32)16-23(27)33/h13-16,31-33H,4-12,17H2,1-3H3