Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C6H8O7.3C4H10N2.12H2O |
Molecular Weight | 858.8372 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.O.O.O.O.O.O.O.O.C1CNCCN1.C2CNCCN2.C3CNCCN3.OC(=O)CC(O)(CC(O)=O)C(O)=O.OC(=O)CC(O)(CC(O)=O)C(O)=O
InChI
InChIKey=ZGLMQWZTYADFME-UHFFFAOYSA-N
InChI=1S/2C6H8O7.3C4H10N2.12H2O/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;3*1-2-6-4-3-5-1;;;;;;;;;;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);3*5-6H,1-4H2;12*1H2
Molecular Formula | C4H10N2 |
Molecular Weight | 86.1356 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C6H8O7 |
Molecular Weight | 192.1235 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
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
Sat Dec 16 13:01:34 GMT 2023
by
admin
on
Sat Dec 16 13:01:34 GMT 2023
|
Record UNII |
X8TF8S67TJ
|
Record Status |
Validated (UNII)
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Record Version |
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-
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7487-45-8
Created by
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X8TF8S67TJ
Created by
admin on Sat Dec 16 13:01:35 GMT 2023 , Edited by admin on Sat Dec 16 13:01:35 GMT 2023
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131801041
Created by
admin on Sat Dec 16 13:01:35 GMT 2023 , Edited by admin on Sat Dec 16 13:01:35 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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ANHYDROUS->SOLVATE |