Important Announcement

X

ChemIDplus is moving to PubChem in December 2022.
Please see the NLM Technical Bulletin article for more information.

Skip Navigation
ChemIDplus LiteBrowseAdvanced

Substance Name: 3-Hydroxy-2-oxoquazepam glucuronide
RN: 96107-52-7
UNII: 81A95YQJ6A
InChIKey: UQEYSCSEDAQQFY-RYQNVSPKSA-N

Molecular Formula

  • C23-H19-Cl-F4-N2-O8

Molecular Weight

  • 562.8541
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 3-Hydroxy-2-oxoquazepam glucuronide

Synonyms

  • 3-Hydroxy-2-oxoquazepam glucuronide
  • beta-D-Glucopyranosiduronic acid, 7-chloro-5-(2-fluorophenyl)-2,3-dihydro-2-oxo-1-(2,2,2-trifluoroethyl)-1H-1,4-benzodiazepin-3-yl
  • UNII-81A95YQJ6A

Registry Numbers

CAS Registry Number

  • 96107-52-7

FDA UNII

  • 81A95YQJ6A

System Generated Number

  • 0096107527

Structure Descriptors

InChI

InChI=1S/C23H19ClF4N2O8/c24-9-5-6-13-11(7-9)14(10-3-1-2-4-12(10)25)29-19(20(34)30(13)8-23(26,27)28)38-22-17(33)15(31)16(32)18(37-22)21(35)36/h1-7,15-19,22,31-33H,8H2,(H,35,36)/t15-,16-,17+,18-,19?,22-/m0/s1

InChIKey

UQEYSCSEDAQQFY-RYQNVSPKSA-N

Smiles

O[C@@H]1[C@@H](O)[C@H](OC2N=C(c3ccccc3F)c4cc(Cl)ccc4N(CC(F)(F)F)C2=O)O[C@@H]([C@H]1O)C(=O)O