Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C10H17N3O5S3.C2H2O4 |
| Molecular Weight | 445.489 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.COCCCN1C[C@H](N)C2=C(SC(=C2)S(N)(=O)=O)S1(=O)=O
InChI
InChIKey=SADPWQTWTRQXLQ-QRPNPIFTSA-N
InChI=1S/C10H17N3O5S3.C2H2O4/c1-18-4-2-3-13-6-8(11)7-5-9(20(12,14)15)19-10(7)21(13,16)17;3-1(4)2(5)6/h5,8H,2-4,6,11H2,1H3,(H2,12,14,15);(H,3,4)(H,5,6)/t8-;/m0./s1
| Molecular Formula | C2H2O4 |
| Molecular Weight | 90.0349 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C10H17N3O5S3 |
| Molecular Weight | 355.454 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:35:19 GMT 2025
by
admin
on
Mon Mar 31 23:35:19 GMT 2025
|
| Record UNII |
TRM8CEW4NR
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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TRM8CEW4NR
Created by
admin on Mon Mar 31 23:35:19 GMT 2025 , Edited by admin on Mon Mar 31 23:35:19 GMT 2025
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155923154
Created by
admin on Mon Mar 31 23:35:19 GMT 2025 , Edited by admin on Mon Mar 31 23:35:19 GMT 2025
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1076385
Created by
admin on Mon Mar 31 23:35:19 GMT 2025 , Edited by admin on Mon Mar 31 23:35:19 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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