Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C13H17N5O8S2.C6H14N2O2 |
Molecular Weight | 581.62 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCC[C@H](N)C(O)=O.C[C@H]1[C@H](NC(=O)C(=N/OC(C)(C)C(O)=O)\C2=CSC(N)=N2)C(=O)N1S(O)(=O)=O
InChI
InChIKey=KPPBAEVZLDHCOK-JHBYREIPSA-N
InChI=1S/C13H17N5O8S2.C6H14N2O2/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22;7-4-2-1-3-5(8)6(9)10/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25);5H,1-4,7-8H2,(H,9,10)/b17-8-;/t5-,7-;5-/m00/s1
Molecular Formula | C6H14N2O2 |
Molecular Weight | 146.1876 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C13H17N5O8S2 |
Molecular Weight | 435.433 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:04:03 UTC 2023
by
admin
on
Fri Dec 15 16:04:03 UTC 2023
|
Record UNII |
XNM7LT65NP
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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EU-Orphan Drug |
EU/3/04/204
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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EMA ASSESSMENT REPORTS |
CAYSTON (AUTHORIZED: CYSTIC FIBROSIS)
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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NCI_THESAURUS |
C260
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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Code System | Code | Type | Description | ||
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C76021
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY | |||
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m2188
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY | Merck Index | ||
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XNM7LT65NP
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY | |||
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CHEMBL3545256
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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11204019
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY | |||
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100000115887
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY | |||
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DBSALT001061
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admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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RR-114
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY | |||
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SUB30777
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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827611-49-4
Created by
admin on Fri Dec 15 16:04:03 UTC 2023 , Edited by admin on Fri Dec 15 16:04:03 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |