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Substance Name: alpha-Tocopherol nicotinate, DL-
RN: 51898-34-1
UNII: QCP2FMP7I8
InChIKey: MSCCTZZBYHQMQJ-AZAGJHQNSA-N

Molecular Formula

  • C35-H53-N-O3

Molecular Weight

  • 535.8077
 
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Names and Synonyms

Name of Substance

  • alpha-Tocopherol nicotinate, DL-

Synonyms

  • EINECS 257-501-4
  • UNII-QCP2FMP7I8

Systematic Name

  • (2R*(4R*,8R*))-(1)-3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate

Registry Numbers

CAS Registry Number

  • 51898-34-1

FDA UNII

  • QCP2FMP7I8

System Generated Number

  • 0051898341

Structure Descriptors

InChI

1S/C35H53NO3/c1-24(2)13-9-14-25(3)15-10-16-26(4)17-11-20-35(8)21-19-31-29(7)32(27(5)28(6)33(31)39-35)38-34(37)30-18-12-22-36-23-30/h12,18,22-26H,9-11,13-17,19-21H2,1-8H3/t25-,26-,35-/m1/s1

InChIKey

MSCCTZZBYHQMQJ-AZAGJHQNSA-N

Smiles

CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(OC(=O)c3cccnc3)c(C)c(C)c2O1