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Substance Name: Octanoylglucuronide
RN: 99910-55-1
InChIKey: ASFORWUCPCKFPY-BYNIDDHOSA-N

Molecular Weight

  • 320.336
 
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Names and Synonyms

Name of Substance

  • Octanoylglucuronide

Synonym

  • Octanoyl-beta-D-glucuronide

Registry Numbers

CAS Registry Number

  • 99910-55-1

System Generated Number

  • 0099910551

Structure Descriptors

InChI

1S/C14H24O8/c1-2-3-4-5-6-7-8(15)21-14-11(18)9(16)10(17)12(22-14)13(19)20/h9-12,14,16-18H,2-7H2,1H3,(H,19,20)/t9-,10-,11+,12-,14+/m0/s1

InChIKey

ASFORWUCPCKFPY-BYNIDDHOSA-N

Smiles

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