butyl (5R)-3,5-diacetyloxy-4-[(E)-3-(4-acetyloxy-3-methoxy-phenyl)prop-2-enoyl]oxy-1-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: butyl (5R)-3,5-diacetyloxy-4-[(E)-3-(4-acetyloxy-3-methoxy-phenyl)prop-2-enoyl]oxy-1-oxidanyl-cyclohexane-1-carboxylate Openeye Name: butyl (5R)-3,5-diacetoxy-4-[(E)-3-(4-acetoxy-3-methoxy-phenyl)prop-2-enoyl]oxy-1-hydroxy-cyclohexanecarboxylate CAS Name: (5R)-3,5-diacetyloxy-4-[(E)-3-(4-acetyloxy-3-methoxyphenyl)-1-oxoprop-2-enoxy]-1-hydroxy-1-cyclohexanecarboxylic acid butyl ester IUPAC Name: butyl (5R)-3,5-diacetyloxy-4-[(E)-3-(4-acetyloxy-3-methoxyphenyl)prop-2-enoyl]oxy-1-hydroxycyclohexane-1-carboxylate Traditional Name: (5R)-3,5-diacetoxy-4-[(E)-3-(4-acetoxy-3-methoxy-phenyl)acryloyl]oxy-1-hydroxy-cyclohexanecarboxylic acid butyl ester Formula: C27H34O12 MolecularWeight: 550.55166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1(CC(C(C(C1)OC(=O)C)OC(=O)C=CC2=CC(=C(C=C2)OC(=O)C)OC)OC(=O)C)O

Isomeric SMILES

CCCCOC(=O)C1(C[C@H](C(C(C1)OC(=O)C)OC(=O)/C=C/C2=CC(=C(C=C2)OC(=O)C)OC)OC(=O)C)O

InChI

InChI=1S/C27H34O12/c1-6-7-12-35-26(32)27(33)14-22(37-17(3)29)25(23(15-27)38-18(4)30)39-24(31)11-9-19-8-10-20(36-16(2)28)21(13-19)34-5/h8-11,13,22-23,25,33H,6-7,12,14-15H2,1-5H3/b11-9+/t22-,23?,25?,27?/m1/s1