Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C9H10NO3.C4H8N2O3.3C4H6NO4.Ca.2H |
| Molecular Weight | 750.677 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H+].[H+].[Ca++].N[C@@H](CC(N)=O)C(O)=O.N[C@@H](CC([O-])=O)C(O)=O.N[C@@H](CC([O-])=O)C(O)=O.N[C@@H](CC([O-])=O)C(O)=O.N[C@@H](CC1=CC=C([O-])C=C1)C(O)=O
InChI
InChIKey=CNYYVWZRMLGSQC-ALFJZUFNSA-L
InChI=1S/C9H11NO3.C4H8N2O3.3C4H7NO4.Ca/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;4*5-2(4(8)9)1-3(6)7;/h1-4,8,11H,5,10H2,(H,12,13);2H,1,5H2,(H2,6,7)(H,8,9);3*2H,1,5H2,(H,6,7)(H,8,9);/q;;;;;+2/p-2/t8-;4*2-;/m00000./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
138454959
Created by
admin on Wed Apr 02 00:11:10 GMT 2025 , Edited by admin on Wed Apr 02 00:11:10 GMT 2025
|
PRIMARY | |||
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QH9YLC4UT2
Created by
admin on Wed Apr 02 00:11:10 GMT 2025 , Edited by admin on Wed Apr 02 00:11:10 GMT 2025
|
PRIMARY |
SUBSTANCE RECORD
