Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H14N6O6S |
| Molecular Weight | 382.3535 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@]([H])([C@@]2([H])SC1)N=C(Cn3cnnn3)O
InChI
InChIKey=PIXMOMPJMIAMLJ-BXKDBHETSA-N
InChI=1S/C13H14N6O6S/c1-6(20)25-3-7-4-26-12-9(11(22)19(12)10(7)13(23)24)15-8(21)2-18-5-14-16-17-18/h5,9,12H,2-4H2,1H3,(H,15,21)(H,23,24)/t9-,12-/m1/s1
| Molecular Formula | C13H14N6O6S |
| Molecular Weight | 382.3535 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Jun 26 05:50:07 UTC 2021
by
admin
on
Sat Jun 26 05:50:07 UTC 2021
|
| Record UNII |
J0730018DF
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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J0730018DF
Created by
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32510-61-5
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11740601
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251-075-3
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admin on Sat Jun 26 05:50:07 UTC 2021 , Edited by admin on Sat Jun 26 05:50:07 UTC 2021
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
|
