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Substance Name: 4-Methylumbelliferylcellobioside
RN: 72626-61-0
InChIKey: PRTGXBPFDYMIJH-MKQZUAMYSA-N

Note

  • Substrate for cellobiohydrolase I.

Molecular Formula

  • C22-H28-O13

Molecular Weight

  • 500.45
 
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Names and Synonyms

Name of Substance

  • 4-Methylumbelliferylcellobioside

Synonym

  • EINECS 276-744-7

Systematic Names

  • 2H-1-Benzopyran-2-one, 7-((4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-4-methyl-
  • 7-((4-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy)-4-methyl-2H-1-benzopyran-2-one

Registry Numbers

CAS Registry Number

  • 72626-61-0

System Generated Number

  • 0072626610

Structure Descriptors

InChI

1S/C22H28O13/c1-8-4-14(25)32-11-5-9(2-3-10(8)11)31-21-19(30)17(28)20(13(7-24)34-21)35-22-18(29)16(27)15(26)12(6-23)33-22/h2-5,12-13,15-24,26-30H,6-7H2,1H3/t12-,13-,15-,16+,17-,18-,19-,20-,21-,22+/m1/s1

InChIKey

PRTGXBPFDYMIJH-MKQZUAMYSA-N

Smiles

O1[C@H](CO)[C@H]([C@H](O)[C@H]([C@@H]1O[C@H]1[C@H](O)[C@H]([C@@H](O[C@@H]1CO)Oc1cc2c(cc1)c(cc(o2)=O)C)O)O)O