Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C9H17NO5.C4H6N4O3.Ca |
| Molecular Weight | 417.428 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 2 |
| E/Z Centers | 0 |
| Charge | 2 |
SHOW SMILES / InChI
SMILES
[Ca++].NC(=O)NC1NC(=O)NC1=O.CC(C)(CO)[C@@H](O)C(=O)NCCC(O)=O
InChI
InChIKey=RKHUXMOKLPDAKM-KLXURFKVSA-N
InChI=1S/C9H17NO5.C4H6N4O3.Ca/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;5-3(10)6-1-2(9)8-4(11)7-1;/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);1H,(H3,5,6,10)(H2,7,8,9,11);/q;;+2/t7-;;/m0../s1
Approval Year
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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2045944
Created by
admin on Sat Dec 16 00:01:30 GMT 2023 , Edited by admin on Sat Dec 16 00:01:30 GMT 2023
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4207-41-4
Created by
admin on Sat Dec 16 00:01:30 GMT 2023 , Edited by admin on Sat Dec 16 00:01:30 GMT 2023
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71586804
Created by
admin on Sat Dec 16 00:01:30 GMT 2023 , Edited by admin on Sat Dec 16 00:01:30 GMT 2023
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SM1342S52N
Created by
admin on Sat Dec 16 00:01:30 GMT 2023 , Edited by admin on Sat Dec 16 00:01:30 GMT 2023
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PRIMARY | |||
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DTXSID80194911
Created by
admin on Sat Dec 16 00:01:30 GMT 2023 , Edited by admin on Sat Dec 16 00:01:30 GMT 2023
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PRIMARY | |||
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SM1342S52N
Created by
admin on Sat Dec 16 00:01:30 GMT 2023 , Edited by admin on Sat Dec 16 00:01:30 GMT 2023
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
