tritert-butyl (2R,3R,6E,10Z)-2-oxidanyl-5-oxidanylidene-nonadeca-6,10-diene-1,2,3-tricarboxylate

Systemtic Name: tritert-butyl (2R,3R,6E,10Z)-2-oxidanyl-5-oxidanylidene-nonadeca-6,10-diene-1,2,3-tricarboxylate Openeye Name: tritert-butyl (2R,3R,6E,10Z)-2-hydroxy-5-oxo-nonadeca-6,10-diene-1,2,3-tricarboxylate CAS Name: (2R,3R,6E,10Z)-2-hydroxy-5-oxononadeca-6,10-diene-1,2,3-tricarboxylic acid tritert-butyl ester IUPAC Name: tritert-butyl (2R,3R,6E,10Z)-2-hydroxy-5-oxononadeca-6,10-diene-1,2,3-tricarboxylate Traditional Name: (2R,3R,6E,10Z)-2-hydroxy-5-keto-nonadeca-6,10-diene-1,2,3-tricarboxylic acid tritert-butyl ester Formula: C34H58O8 MolecularWeight: 594.81952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCC=CC(=O)CC(C(=O)OC(C)(C)C)C(CC(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)O

Isomeric SMILES

CCCCCCCC/C=C\CC/C=C/C(=O)C[C@@H](C(=O)OC(C)(C)C)[C@](CC(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)O

InChI

InChI=1S/C34H58O8/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-26(35)24-27(29(37)41-32(5,6)7)34(39,30(38)42-33(8,9)10)25-28(36)40-31(2,3)4/h18-19,22-23,27,39H,11-17,20-21,24-25H2,1-10H3/b19-18-,23-22+/t27-,34+/m0/s1