Details
Stereochemistry | ACHIRAL |
Molecular Formula | C9H8O4.2Al.3O |
Molecular Weight | 282.1187 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[O--].[O--].[O--].[Al+3].[Al+3].CC(=O)OC1=C(C=CC=C1)C(O)=O
InChI
InChIKey=MXCPYJZDGPQDRA-UHFFFAOYSA-N
InChI=1S/C9H8O4.2Al.3O/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;;;;;/h2-5H,1H3,(H,11,12);;;;;/q;2*+3;3*-2
Molecular Formula | C9H7O4 |
Molecular Weight | 179.1495 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | Al |
Molecular Weight | 26.9815 |
Charge | 3 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | HO |
Molecular Weight | 17.0073 |
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
Fri Dec 15 17:43:43 UTC 2023
by
admin
on
Fri Dec 15 17:43:43 UTC 2023
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Record UNII |
6QT214X4XU
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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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WHO-ATC |
B01AC15
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WHO-ATC |
N02BA02
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WHO-VATC |
QN02BA02
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admin on Fri Dec 15 17:43:43 UTC 2023 , Edited by admin on Fri Dec 15 17:43:43 UTC 2023
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WHO-VATC |
QB01AC15
Created by
admin on Fri Dec 15 17:43:43 UTC 2023 , Edited by admin on Fri Dec 15 17:43:43 UTC 2023
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Code System | Code | Type | Description | ||
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DB13509
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17393
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100000078838
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ALOXIPRIN
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CHEMBL2108222
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1373
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m1575
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DTXSID60238044
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C010843
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SUB00370MIG
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71586929
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4760
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C166958
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6QT214X4XU
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9014-67-9
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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SALT/SOLVATE -> PARENT |
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ACTIVE MOIETY |