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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H38N6O9
Molecular Weight 614.6468
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-nitroso-tigecycline

SMILES

CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)C(O)=C(NC(=O)CN(N=O)C(C)(C)C)C=C4N(C)C

InChI

InChIKey=UPLQLKDQCXKUCY-HJYUBDRYSA-N
InChI=1S/C29H38N6O9/c1-28(2,3)35(32-44)11-17(36)31-15-10-16(33(4)5)13-8-12-9-14-21(34(6)7)24(39)20(27(30)42)26(41)29(14,43)25(40)18(12)23(38)19(13)22(15)37/h10,12,14,21,37,39-40,43H,8-9,11H2,1-7H3,(H2,30,42)(H,31,36)/t12-,14-,21-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H38N6O9
Molecular Weight 614.6468
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:25:04 GMT 2025
Edited
by admin
on Wed Apr 02 18:25:04 GMT 2025
Record UNII
JQC2FGG3LM
Record Status Validated (UNII)
Record Version
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Name Type Language
N-nitroso-tigecycline
Preferred Name English
Code System Code Type Description
FDA UNII
JQC2FGG3LM
Created by admin on Wed Apr 02 18:25:04 GMT 2025 , Edited by admin on Wed Apr 02 18:25:04 GMT 2025
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