O14-methyl O1-(phenylmethyl) (2S,3S)-3-oxidanyl-2-[(triphenylmethyl)oxymethyl]tetradecanedioate

Systemtic Name: O14-methyl O1-(phenylmethyl) (2S,3S)-3-oxidanyl-2-[(triphenylmethyl)oxymethyl]tetradecanedioate Openeye Name: O1-benzyl O14-methyl (2S,3S)-3-hydroxy-2-(trityloxymethyl)tetradecanedioate CAS Name: (2S,3S)-3-hydroxy-2-[(triphenylmethyl)oxymethyl]tetradecanedioic acid O14-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 14-O-methyl (2S,3S)-3-hydroxy-2-(trityloxymethyl)tetradecanedioate Traditional Name: (2S,3S)-3-hydroxy-2-(trityloxymethyl)tetradecanedioic acid O1-benzyl ester O14-methyl ester Formula: C42H50O6 MolecularWeight: 650.8428

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCCCC(C(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)O

Isomeric SMILES

COC(=O)CCCCCCCCCC[C@@H]([C@H](COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)O

InChI

InChI=1S/C42H50O6/c1-46-40(44)31-21-7-5-3-2-4-6-20-30-39(43)38(41(45)47-32-34-22-12-8-13-23-34)33-48-42(35-24-14-9-15-25-35,36-26-16-10-17-27-36)37-28-18-11-19-29-37/h8-19,22-29,38-39,43H,2-7,20-21,30-33H2,1H3/t38-,39-/m0/s1