Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C9H8O4.C6H14N2O2 |
| Molecular Weight | 326.345 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCC[C@H](N)C(O)=O.CC(=O)OC1=C(C=CC=C1)C(O)=O
InChI
InChIKey=JJBCTCGUOQYZHK-ZSCHJXSPSA-N
InChI=1S/C9H8O4.C6H14N2O2/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;7-4-2-1-3-5(8)6(9)10/h2-5H,1H3,(H,11,12);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1
| Molecular Formula | C6H14N2O2 |
| Molecular Weight | 146.1876 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C9H8O4 |
| Molecular Weight | 180.1574 |
| Charge | 0 |
| 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
Fri Dec 15 15:33:09 UTC 2023
by
admin
on
Fri Dec 15 15:33:09 UTC 2023
|
| Record UNII |
XAN4V337CI
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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FDA ORPHAN DRUG |
33988
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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253-723-0
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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PRIMARY | |||
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91626
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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PRIMARY | |||
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XAN4V337CI
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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37933-78-1
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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PRIMARY | |||
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SUB34053
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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PRIMARY | |||
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100000127914
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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PRIMARY | |||
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DTXSID30958944
Created by
admin on Fri Dec 15 15:33:09 UTC 2023 , Edited by admin on Fri Dec 15 15:33:09 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |