Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H20N3O6S.H4N |
| Molecular Weight | 400.45 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[NH4+].CC1(C)S[C@@H](N[C@H]1C([O-])=O)[C@H](NC(=O)[C@H](N)C2=CC=C(O)C=C2)C(O)=O
InChI
InChIKey=QNRWSLPWZRYVHF-ODFUGKNXSA-N
InChI=1S/C16H21N3O6S.H3N/c1-16(2)11(15(24)25)19-13(26-16)10(14(22)23)18-12(21)9(17)7-3-5-8(20)6-4-7;/h3-6,9-11,13,19-20H,17H2,1-2H3,(H,18,21)(H,22,23)(H,24,25);1H3/t9-,10+,11+,13-;/m1./s1
| Molecular Formula | C16H20N3O6S |
| Molecular Weight | 382.412 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H4N |
| Molecular Weight | 18.0385 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 19:48:29 GMT 2025
by
admin
on
Wed Apr 02 19:48:29 GMT 2025
|
| Record UNII |
8CX2PZD2J5
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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171382672
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1204829-51-5
Created by
admin on Wed Apr 02 19:48:29 GMT 2025 , Edited by admin on Wed Apr 02 19:48:29 GMT 2025
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