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Substance Name: Sucrose octaisobutyrate
RN: 102787-19-9
UNII: O7704K0GMS
InChIKey: QSOGLNCCKWUXRN-CIGKAFDASA-N

Molecular Formula

  • C44-H70-O19

Molecular Weight

  • 903.018
 
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Names and Synonyms

Name of Substance

  • Sucrose octaisobutyrate

Synonyms

  • Sucrose octa-isobutyrate
  • UNII-O7704K0GMS

Systematic Name

  • alpha-D-Glucopyranoside, 1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-beta-D-fructofuranosyl, tetrakis(2-methylpropanoate)

Registry Numbers

CAS Registry Number

  • 102787-19-9

FDA UNII

  • O7704K0GMS

System Generated Number

  • 0102787199

Structure Descriptors

InChI

1S/C44H70O19/c1-20(2)35(45)53-17-28-30(57-38(48)23(7)8)32(59-40(50)25(11)12)33(60-41(51)26(13)14)43(56-28)63-44(19-55-37(47)22(5)6)34(61-42(52)27(15)16)31(58-39(49)24(9)10)29(62-44)18-54-36(46)21(3)4/h20-34,43H,17-19H2,1-16H3/t28-,29-,30-,31-,32+,33-,34+,43-,44+/m1/s1

InChIKey

QSOGLNCCKWUXRN-CIGKAFDASA-N

Smiles

O1[C@H](O[C@@]2(O[C@@H]([C@H]([C@@H]2OC(C(C)C)=O)OC(C(C)C)=O)COC(C(C)C)=O)COC(C(C)C)=O)[C@@H]([C@H]([C@@H]([C@H]1COC(=O)C(C)C)OC(C(C)C)=O)OC(C(C)C)=O)OC(C(C)C)=O