2-oxidanyl-3-[1,5,5-tris(2-oxidanyl-4-oxidanylidene-chromen-3-yl)pentyl]chromen-4-one

Systemtic Name: 2-oxidanyl-3-[1,5,5-tris(2-oxidanyl-4-oxidanylidene-chromen-3-yl)pentyl]chromen-4-one Openeye Name: 2-hydroxy-3-[1,5,5-tris(2-hydroxy-4-oxo-chromen-3-yl)pentyl]chromen-4-one CAS Name: 2-hydroxy-3-[1,5,5-tris(2-hydroxy-4-oxo-1-benzopyran-3-yl)pentyl]-1-benzopyran-4-one IUPAC Name: 2-hydroxy-3-[1,5,5-tris(2-hydroxy-4-oxochromen-3-yl)pentyl]chromen-4-one Traditional Name: 2-hydroxy-3-[1,5,5-tris(2-hydroxy-4-keto-chromen-3-yl)pentyl]chromone Formula: C41H28O12 MolecularWeight: 712.65382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)C(CCCC(C3=C(OC4=CC=CC=C4C3=O)O)C5=C(OC6=CC=CC=C6C5=O)O)C7=C(OC8=CC=CC=C8C7=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)C(CCCC(C3=C(OC4=CC=CC=C4C3=O)O)C5=C(OC6=CC=CC=C6C5=O)O)C7=C(OC8=CC=CC=C8C7=O)O

InChI

InChI=1S/C41H28O12/c42-34-20-10-1-5-16-26(20)50-38(46)30(34)24(31-35(43)21-11-2-6-17-27(21)51-39(31)47)14-9-15-25(32-36(44)22-12-3-7-18-28(22)52-40(32)48)33-37(45)23-13-4-8-19-29(23)53-41(33)49/h1-8,10-13,16-19,24-25,46-49H,9,14-15H2