Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H41N5O12.2H2O.2H2O4S |
| Molecular Weight | 787.764 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 15 / 15 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.OS(O)(=O)=O.OS(O)(=O)=O.[H][C@@]3(O[C@@H]1[C@@H](O)[C@@H](C[C@H](N)[C@H]1O[C@@]2([H])O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)NC(=O)[C@@H](O)CCN)O[C@H](CO)[C@H](O)[C@H]3O
InChI
InChIKey=IUQWHBUMCWSQIM-VQXSWOJCSA-N
InChI=1S/C21H41N5O12.2H2O4S.2H2O/c22-2-1-8(28)19(34)26-7-3-6(24)17(37-20-11(25)15(32)13(30)9(4-23)35-20)18(12(7)29)38-21-16(33)14(31)10(5-27)36-21;2*1-5(2,3)4;;/h6-18,20-21,27-33H,1-5,22-25H2,(H,26,34);2*(H2,1,2,3,4);2*1H2/t6-,7+,8-,9+,10+,11+,12-,13+,14-,15+,16+,17+,18+,20+,21-;;;;/m0..../s1
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C21H41N5O12 |
| Molecular Weight | 555.5765 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 15 / 15 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:16:48 GMT 2023
by
admin
on
Fri Dec 15 17:16:48 GMT 2023
|
| Record UNII |
A3E6ZU54BA
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
146019457
Created by
admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
|
PRIMARY | |||
|
A3E6ZU54BA
Created by
admin on Fri Dec 15 17:16:48 GMT 2023 , Edited by admin on Fri Dec 15 17:16:48 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
|
|
PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ACTIVE MOIETY |