2-(4-hexadecoxy-3-oxidanyl-phenyl)-3,5,7-tris(oxidanyl)chromen-4-one

Systemtic Name: 2-(4-hexadecoxy-3-oxidanyl-phenyl)-3,5,7-tris(oxidanyl)chromen-4-one Openeye Name: 2-(4-hexadecoxy-3-hydroxy-phenyl)-3,5,7-trihydroxy-chromen-4-one CAS Name: 2-(4-hexadecoxy-3-hydroxyphenyl)-3,5,7-trihydroxy-1-benzopyran-4-one IUPAC Name: 2-(4-hexadecoxy-3-hydroxyphenyl)-3,5,7-trihydroxychromen-4-one Traditional Name: 2-(4-cetyloxy-3-hydroxy-phenyl)-3,5,7-trihydroxy-chromone Formula: C31H42O7 MolecularWeight: 526.66098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O

InChI

InChI=1S/C31H42O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-37-26-17-16-22(19-24(26)33)31-30(36)29(35)28-25(34)20-23(32)21-27(28)38-31/h16-17,19-21,32-34,36H,2-15,18H2,1H3