[(2R,3R,4S)-3,4-diacetyloxy-5-[bis(4-methoxyphenyl)-phenyl-methoxy]-1-[7,8-dimethyl-2,4-bis(oxidanylidene)benzo[g]pteridin-10-yl]pentan-2-yl] ethanoate

Systemtic Name: [(2R,3R,4S)-3,4-diacetyloxy-5-[bis(4-methoxyphenyl)-phenyl-methoxy]-1-[7,8-dimethyl-2,4-bis(oxidanylidene)benzo[g]pteridin-10-yl]pentan-2-yl] ethanoate Openeye Name: [(1R,2R,3S)-2,3-diacetoxy-4-[bis(4-methoxyphenyl)-phenyl-methoxy]-1-[(7,8-dimethyl-2,4-dioxo-benzo[g]pteridin-10-yl)methyl]butyl] acetate CAS Name: acetic acid [(2R,3R,4S)-3,4-diacetyloxy-5-[bis(4-methoxyphenyl)-phenylmethoxy]-1-(7,8-dimethyl-2,4-dioxo-10-benzo[g]pteridinyl)pentan-2-yl] ester IUPAC Name: [(2R,3R,4S)-3,4-diacetyloxy-5-[bis(4-methoxyphenyl)-phenylmethoxy]-1-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)pentan-2-yl] acetate Traditional Name: acetic acid [(1R,2R,3S)-2,3-diacetoxy-4-[bis(4-methoxyphenyl)-phenyl-methoxy]-1-[(2,4-diketo-7,8-dimethyl-benzo[g]pteridin-10-yl)methyl]butyl] ester Formula: C44H44N4O11 MolecularWeight: 804.84036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@H]([C@H]([C@H](COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C44H44N4O11/c1-25-21-35-36(22-26(25)2)48(41-39(45-35)42(52)47-43(53)46-41)23-37(57-27(3)49)40(59-29(5)51)38(58-28(4)50)24-56-44(30-11-9-8-10-12-30,31-13-17-33(54-6)18-14-31)32-15-19-34(55-7)20-16-32/h8-22,37-38,40H,23-24H2,1-7H3,(H,47,52,53)/t37-,38+,40-/m1/s1