U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H20F2N6O7
Molecular Weight 482.3949
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLUCONAZOLE GLUCURONIDE

SMILES

O[C@H]1[C@H](OC(CN2C=NC=N2)(CN3C=NC=N3)C4=C(F)C=C(F)C=C4)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O

InChI

InChIKey=GJQIGLSHRFZUJD-RPUYLAQPSA-N
InChI=1S/C19H20F2N6O7/c20-10-1-2-11(12(21)3-10)19(4-26-8-22-6-24-26,5-27-9-23-7-25-27)34-18-15(30)13(28)14(29)16(33-18)17(31)32/h1-3,6-9,13-16,18,28-30H,4-5H2,(H,31,32)/t13-,14-,15+,16-,18-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
FLUCONAZOLE GLUCURONIDE
Common Name English
FLUCONAZOLE .BETA.-D-GLUCURONIDE
Systematic Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 1-(2,4-DIFLUOROPHENYL)-2-(1H-1,2,4-TRIAZOL-1-YL)-1-(1H-1,2,4-TRIAZOL-1-YLMETHYL)ETHYL
Systematic Name English
Code System Code Type Description
FDA UNII
2KH0107L73
Created by admin on Sat Dec 16 10:52:03 GMT 2023 , Edited by admin on Sat Dec 16 10:52:03 GMT 2023
PRIMARY
CAS
136134-23-1
Created by admin on Sat Dec 16 10:52:03 GMT 2023 , Edited by admin on Sat Dec 16 10:52:03 GMT 2023
PRIMARY
PUBCHEM
71316779
Created by admin on Sat Dec 16 10:52:03 GMT 2023 , Edited by admin on Sat Dec 16 10:52:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID50747791
Created by admin on Sat Dec 16 10:52:03 GMT 2023 , Edited by admin on Sat Dec 16 10:52:03 GMT 2023
PRIMARY