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Substance Name: Cellohexaose
RN: 2478-35-5
InChIKey: DJMVHSOAUQHPSN-VXDFXQCISA-N

Molecular Formula

  • C36-H62-O31

Molecular Weight

  • 990.855
 
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Names and Synonyms

Name of Substance

  • Cellohexaose

Synonyms

  • (Glu-1-4-glu)3
  • O-beta-D-Glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-D-glucose

Systematic Name

  • D-Glucose, O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-

Registry Numbers

CAS Registry Number

  • 2478-35-5

System Generated Number

  • 0002478355

Structure Descriptors

InChI

1S/C36H62O31/c37-1-8(44)15(46)27(9(45)2-38)63-33-23(54)18(49)29(11(4-40)59-33)65-35-25(56)20(51)31(13(6-42)61-35)67-36-26(57)21(52)30(14(7-43)62-36)66-34-24(55)19(50)28(12(5-41)60-34)64-32-22(53)17(48)16(47)10(3-39)58-32/h1,8-36,38-57H,2-7H2/t8-,9+,10+,11+,12+,13+,14+,15+,16+,17-,18+,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34-,35-,36-/m0/s1

InChIKey

DJMVHSOAUQHPSN-VXDFXQCISA-N

Smiles

O1[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)O)O[C@@H]([C@@H]([C@H](C=O)O)O)[C@@H](CO)O)CO)CO)CO)[C@@H]([C@H]2O)O)[C@H](O)[C@H]([C@@H](O)[C@H]1CO)O