(3S,5S,6S)-5,6-bis(4-methoxyphenyl)-3-[(1S,3R)-3-methyl-1-oxidanyl-4-(2,3,6-trimethoxy-5-nitro-phenyl)butyl]-1,4-dioxan-2-one

Systemtic Name: (3S,5S,6S)-5,6-bis(4-methoxyphenyl)-3-[(1S,3R)-3-methyl-1-oxidanyl-4-(2,3,6-trimethoxy-5-nitro-phenyl)butyl]-1,4-dioxan-2-one Openeye Name: (3S,5S,6S)-3-[(1S,3R)-1-hydroxy-3-methyl-4-(2,3,6-trimethoxy-5-nitro-phenyl)butyl]-5,6-bis(4-methoxyphenyl)-1,4-dioxan-2-one CAS Name: (3S,5S,6S)-3-[(1S,3R)-1-hydroxy-3-methyl-4-(2,3,6-trimethoxy-5-nitrophenyl)butyl]-5,6-bis(4-methoxyphenyl)-1,4-dioxan-2-one IUPAC Name: (3S,5S,6S)-3-[(1S,3R)-1-hydroxy-3-methyl-4-(2,3,6-trimethoxy-5-nitrophenyl)butyl]-5,6-bis(4-methoxyphenyl)-1,4-dioxan-2-one Traditional Name: (3S,5S,6S)-3-[(1S,3R)-1-hydroxy-3-methyl-4-(2,3,6-trimethoxy-5-nitro-phenyl)butyl]-5,6-bis(4-methoxyphenyl)-1,4-dioxan-2-one Formula: C32H37NO11 MolecularWeight: 611.63628

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C(=CC(=C1OC)OC)[N+](=O)[O-])OC)CC(C2C(=O)OC(C(O2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)O

Isomeric SMILES

C[C@H](CC1=C(C(=CC(=C1OC)OC)[N+](=O)[O-])OC)C[C@@H]([C@H]2C(=O)O[C@H]([C@@H](O2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)O

InChI

InChI=1S/C32H37NO11/c1-18(15-23-29(41-5)24(33(36)37)17-26(40-4)30(23)42-6)16-25(34)31-32(35)44-28(20-9-13-22(39-3)14-10-20)27(43-31)19-7-11-21(38-2)12-8-19/h7-14,17-18,25,27-28,31,34H,15-16H2,1-6H3/t18-,25+,27+,28+,31+/m1/s1