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Reference substances

Reference substances

Currently viewing:
IUPAC name:
4-oxo-4-{[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl]oxy}butanoic acid

Inventory

EC number:
224-403-8
EC name:
α-tocopheryl hydrogen succinate
CAS number:
4345-03-3
CAS number:
4345-03-3
Synonyms
Names:
Butanedioic acid, mono[(2R)-3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-yl] ester
Butanedioic acid, mono[3,4-dihydro-2,5,7,8- tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran -6-yl] ester, [2R-[2R(4R,8R)]]-
Identifier:
IUPAC name
4-oxo-4-{[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-yl]oxy}butanoic acid

Molecular and structural information

Molecular formula:
C33H54O5
Molecular weight:
530.779
SMILES notation:
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(OC(=O)CCC(=O)O)c(C)c(C)c2O1
InChl:
InChI=1/C33H54O5/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-20-33(8)21-19-28-27(7)31(25(5)26(6)32(28)38-33)37-30(36)18-17-29(34)35/h22-24H,9-21H2,1-8H3,(H,34,35)
Structural formula:
Chemical structure

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