Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C6H10NO3.Fe |
| Molecular Weight | 344.142 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Fe++].CC=N[C@@H]([C@@H](C)O)C([O-])=O.CC=N[C@@H]([C@@H](C)O)C([O-])=O
InChI
InChIKey=LOUBIVSNZNCZTR-SHMRILBWSA-L
InChI=1S/2C6H11NO3.Fe/c2*1-3-7-5(4(2)8)6(9)10;/h2*3-5,8H,1-2H3,(H,9,10);/q;;+2/p-2/b2*7-3-;/t2*4-,5+;/m11./s1
| Molecular Formula | Fe |
| Molecular Weight | 55.845 |
| Charge | 2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C6H10NO3 |
| Molecular Weight | 144.1485 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Sample Use Guides
In Vivo Use Guide
Sources: https://www.drugfuture.com/toxic/q70-q623.html
Curator's Comment: Toxicity data in mice.
Oral LD50 >3 mg/kg. Intraperitoneal LD50 634 mg/kg.
Route of Administration:
Other
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:01:58 GMT 2025
by
admin
on
Mon Mar 31 21:01:58 GMT 2025
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| Record UNII |
844XBK58AV
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| Record Status |
Validated (UNII)
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| Record Version |
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100000080962
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844XBK58AV
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71587474
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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SOLVATE->ANHYDROUS |