Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C5H11NO2.2C5H8NO4.Ca |
| Molecular Weight | 449.467 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CC(C)[C@H](N)C(O)=O.N[C@@H](CCC([O-])=O)C(O)=O.N[C@@H](CCC([O-])=O)C(O)=O
InChI
InChIKey=XFBYWUDTBLMXEF-RSGOKVIVSA-L
InChI=1S/2C5H9NO4.C5H11NO2.Ca/c2*6-3(5(9)10)1-2-4(7)8;1-3(2)4(6)5(7)8;/h2*3H,1-2,6H2,(H,7,8)(H,9,10);3-4H,6H2,1-2H3,(H,7,8);/q;;;+2/p-2/t2*3-;4-;/m000./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
WNV2SNS2LA
Created by
admin on Wed Apr 02 03:03:05 GMT 2025 , Edited by admin on Wed Apr 02 03:03:05 GMT 2025
|
PRIMARY | |||
|
139593540
Created by
admin on Wed Apr 02 03:03:05 GMT 2025 , Edited by admin on Wed Apr 02 03:03:05 GMT 2025
|
PRIMARY |
SUBSTANCE RECORD
