3-hydroxy-N-desalkyl-2-oxoquazepam glucuronide (Q27290179)

UNII-TQV45T629X (English)

14 October 2016

chemical formula

C₂₁H₁₈ClFN₂O₈

1 reference

UNII-TQV45T629X (English)

14 October 2016

canonical SMILES

C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)OC4C(C(C(C(O4)C(=O)O)O)O)O)F

1 reference

UNII-TQV45T629X (English)

14 October 2016

isomeric SMILES

C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)F

1 reference

UNII-TQV45T629X (English)

InChI=1S/C21H18ClFN2O8/c22-8-5-6-12-10(7-8)13(9-3-1-2-4-11(9)23)25-19(18(29)24-12)33-21-16(28)14(26)15(27)17(32-21)20(30)31/h1-7,14-17,19,21,26-28H,(H,24,29)(H,30,31)/t14-,15-,16+,17-,19?,21-/m0/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-TQV45T629X (English)

XMIUOBOPNGKMER-IFBJMGMISA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-TQV45T629X (English)

14 October 2016

1 reference

UNII

TQV45T629X

3-hydroxy-N-desalkyl-2-oxoquazepam glucuronide (English)

14 October 2016

1 reference

7-Chloro-5-(2-fluorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-3-yl beta-D-glucopyranosiduronic acid (English)

14 October 2016

2 references

UNII-TQV45T629X (English)

matched by identifier from

14 October 2016

InChIKey

XMIUOBOPNGKMER-IFBJMGMISA-N

1 reference

2 references

Global Substance Registration System

UNII

TQV45T629X

3-hydroxy-N-desalkyl-2-oxoquazepam glucuronide (English)