Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H17N7O6.Ca |
| Molecular Weight | 479.46 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].NC1=NC2=C(N=C(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)C=N2)C(=O)N1
InChI
InChIKey=KRPUUUJWTZKSOK-YDALLXLXSA-L
InChI=1S/C19H19N7O6.Ca/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28;/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30);/q;+2/p-2/t12-;/m0./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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42J663XLK6
Created by
admin on Wed Apr 02 05:17:06 GMT 2025 , Edited by admin on Wed Apr 02 05:17:06 GMT 2025
|
PRIMARY | |||
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78168-16-8
Created by
admin on Wed Apr 02 05:17:06 GMT 2025 , Edited by admin on Wed Apr 02 05:17:06 GMT 2025
|
PRIMARY | |||
|
101593504
Created by
admin on Wed Apr 02 05:17:06 GMT 2025 , Edited by admin on Wed Apr 02 05:17:06 GMT 2025
|
PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
