Details
Stereochemistry | UNKNOWN |
Molecular Formula | C12H18N4O6S |
Molecular Weight | 346.36 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 0 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)NC(CSCC(O)CN1C(C)=NC=C1[N+]([O-])=O)C(O)=O
InChI
InChIKey=QHKYXHXQRMXJIQ-UHFFFAOYSA-N
InChI=1S/C12H18N4O6S/c1-7-13-3-11(16(21)22)15(7)4-9(18)5-23-6-10(12(19)20)14-8(2)17/h3,9-10,18H,4-6H2,1-2H3,(H,14,17)(H,19,20)
Molecular Formula | C12H18N4O6S |
Molecular Weight | 346.36 |
Charge | 0 |
Count |
|
Stereochemistry | MIXED |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:15:36 GMT 2023
by
admin
on
Sat Dec 16 15:15:36 GMT 2023
|
Record UNII |
DNT1PO1U8A
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DNT1PO1U8A
Created by
admin on Sat Dec 16 15:15:36 GMT 2023 , Edited by admin on Sat Dec 16 15:15:36 GMT 2023
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145996794
Created by
admin on Sat Dec 16 15:15:36 GMT 2023 , Edited by admin on Sat Dec 16 15:15:36 GMT 2023
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PRIMARY |
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PARENT -> METABOLITE |
URINE
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