4-(5-methyl-2-prop-1-en-2-yl-hex-4-enyl)-1,3,5,6-tetrakis(oxidanyl)xanthen-9-one

Systemtic Name: 4-(5-methyl-2-prop-1-en-2-yl-hex-4-enyl)-1,3,5,6-tetrakis(oxidanyl)xanthen-9-one Openeye Name: 1,3,5,6-tetrahydroxy-4-(2-isopropenyl-5-methyl-hex-4-enyl)xanthen-9-one CAS Name: 1,3,5,6-tetrahydroxy-4-[5-methyl-2-(1-methylethenyl)hex-4-enyl]-9-xanthenone IUPAC Name: 1,3,5,6-tetrahydroxy-4-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)xanthen-9-one Traditional Name: 1,3,5,6-tetrahydroxy-4-(2-isopropenyl-5-methyl-hex-4-enyl)xanthone Formula: C23H24O6 MolecularWeight: 396.43306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(CC1=C(C=C(C2=C1OC3=C(C2=O)C=CC(=C3O)O)O)O)C(=C)C)C

Isomeric SMILES

CC(=CCC(CC1=C(C=C(C2=C1OC3=C(C2=O)C=CC(=C3O)O)O)O)C(=C)C)C

InChI

InChI=1S/C23H24O6/c1-11(2)5-6-13(12(3)4)9-15-17(25)10-18(26)19-20(27)14-7-8-16(24)21(28)23(14)29-22(15)19/h5,7-8,10,13,24-26,28H,3,6,9H2,1-2,4H3