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Substance Name: Rhein 8-beta-D-Glucuronide
RN: 70793-10-1
InChIKey: PCIJYIRYSXMDQB-HUTLKBDOSA-N

Molecular Formula

  • C21-H16-O12

Molecular Weight

  • 460.345
 
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Names and Synonyms

Results Name

  • Rhein 8-beta-D-Glucuronide

Systematic Name

  • beta-D-Glucopyranosiduronic acid, 6-carboxy-9,10-dihydro-8-hydroxy-9,10-dioxo-1-anthracenyl

Registry Numbers

CAS Registry Number

  • 70793-10-1

System Generated Number

  • 0070793101

Structure Descriptors

InChI

1S/C21H16O12/c22-9-5-6(19(28)29)4-8-11(9)14(24)12-7(13(8)23)2-1-3-10(12)32-21-17(27)15(25)16(26)18(33-21)20(30)31/h1-5,15-18,21-22,25-27H,(H,28,29)(H,30,31)/t15-,16-,17+,18-,21+/m0/s1

InChIKey

PCIJYIRYSXMDQB-HUTLKBDOSA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)c1cccc2C(c3cc(cc(c3C(c12)=O)O)C(=O)O)=O