Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C11H14N2S.C4H6O6 |
Molecular Weight | 356.394 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CN1CCCN=C1\C=C\C2=CC=CS2
InChI
InChIKey=VWRCYAZJKNPEQR-NIEARKAZSA-N
InChI=1S/C11H14N2S.C4H6O6/c1-13-8-3-7-12-11(13)6-5-10-4-2-9-14-10;5-1(3(7)8)2(6)4(9)10/h2,4-6,9H,3,7-8H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/b6-5+;/t;1-,2-/m.1/s1
Molecular Formula | C4H6O6 |
Molecular Weight | 150.0868 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C11H14N2S |
Molecular Weight | 206.307 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:09:03 UTC 2023
by
admin
on
Sat Dec 16 05:09:03 UTC 2023
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Record UNII |
SC82VF0480
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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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CFR |
21 CFR 520.2046
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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CFR |
21 CFR 520.2045
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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CFR |
21 CFR 556.560
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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NCI_THESAURUS |
C250
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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Code System | Code | Type | Description | ||
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6434144
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1584105
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33401-94-4
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DBSALT001617
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DTXSID4048858
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admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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2197593
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admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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7085-69-0
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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ALTERNATIVE | |||
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CHEMBL1626223
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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300000023773
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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SC82VF0480
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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251-501-8
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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SC82VF0480
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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m9336
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 UTC 2023
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PRIMARY | Merck Index | ||
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C90731
Created by
admin on Sat Dec 16 05:09:03 UTC 2023 , Edited by admin on Sat Dec 16 05:09:03 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 |
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ACTIVE MOIETY |