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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H21ClFN3O6
Molecular Weight 501.891
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIDAZOLAM N-GLUCORONIDE

SMILES

CC1=[N+](C=C2CN=C(C3=CC=CC=C3F)C4=CC(Cl)=CC=C4N12)[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C([O-])=O

InChI

InChIKey=ULVPQZCKSQYJQR-USWKJHDZSA-N
InChI=1S/C24H21ClFN3O6/c1-11-28(23-21(32)19(30)20(31)22(35-23)24(33)34)10-13-9-27-18(14-4-2-3-5-16(14)26)15-8-12(25)6-7-17(15)29(11)13/h2-8,10,19-23,30-32H,9H2,1H3/t19-,20-,21+,22-,23+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H22ClFN3O6
Molecular Weight 502.899
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
HHX6BAQ2JX
Record Status Validated (UNII)
Record Version