Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H21N7O7.Ca |
| Molecular Weight | 511.501 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].NC1=NC(=O)C2=C(NC[C@@H](CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
InChI
InChIKey=KVUAALJSMIVURS-KZCZEQIWSA-L
InChI=1S/C20H23N7O7.Ca/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32);/q;+2/p-2/t12-,13+;/m1./s1
| Molecular Formula | Ca |
| Molecular Weight | 40.078 |
| Charge | 2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C20H21N7O7 |
| Molecular Weight | 471.4234 |
| Charge | -2 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:12:35 GMT 2025
by
admin
on
Mon Mar 31 18:12:35 GMT 2025
|
| Record UNII |
8E32LZ77C1
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Preferred Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
115940-48-2
Created by
admin on Mon Mar 31 18:12:35 GMT 2025 , Edited by admin on Mon Mar 31 18:12:35 GMT 2025
|
PRIMARY | |||
|
8E32LZ77C1
Created by
admin on Mon Mar 31 18:12:35 GMT 2025 , Edited by admin on Mon Mar 31 18:12:35 GMT 2025
|
PRIMARY | |||
|
135484650
Created by
admin on Mon Mar 31 18:12:35 GMT 2025 , Edited by admin on Mon Mar 31 18:12:35 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> SALT/SOLVATE |
|
