[3-methoxy-4,6-bis(3-methylbut-2-enyl)-7-oxidanyl-10-oxidanylidene-9H-anthracen-2-yl] hexadecanoate

Systemtic Name: [3-methoxy-4,6-bis(3-methylbut-2-enyl)-7-oxidanyl-10-oxidanylidene-9H-anthracen-2-yl] hexadecanoate Openeye Name: [7-hydroxy-3-methoxy-4,6-bis(3-methylbut-2-enyl)-10-oxo-9H-anthracen-2-yl] hexadecanoate CAS Name: hexadecanoic acid [7-hydroxy-3-methoxy-4,6-bis(3-methylbut-2-enyl)-10-oxo-9H-anthracen-2-yl] ester IUPAC Name: [7-hydroxy-3-methoxy-4,6-bis(3-methylbut-2-enyl)-10-oxo-9H-anthracen-2-yl] hexadecanoate Traditional Name: palmitic acid [7-hydroxy-10-keto-3-methoxy-4,6-bis(3-methylbut-2-enyl)-9H-anthracen-2-yl] ester Formula: C41H58O5 MolecularWeight: 630.89622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1=C(C(=C2C(=C1)CC3=CC(=C(C=C3C2=O)CC=C(C)C)O)CC=C(C)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1=C(C(=C2C(=C1)CC3=CC(=C(C=C3C2=O)CC=C(C)C)O)CC=C(C)C)OC

InChI

InChI=1S/C41H58O5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-38(43)46-37-28-33-25-32-27-36(42)31(23-21-29(2)3)26-35(32)40(44)39(33)34(41(37)45-6)24-22-30(4)5/h21-22,26-28,42H,7-20,23-25H2,1-6H3