Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | 2C20H25N3O4.2C4H6O5.H2O |
| Molecular Weight | 1029.0506 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.OC(CC(O)=O)C(O)=O.OC(CC(O)=O)C(O)=O.COC1=C2N(C=C(C(O)=O)C(=O)C2=CC=C1N3C[C@@H](C)C[C@H](N)C3)C4CC4.COC5=C6N(C=C(C(O)=O)C(=O)C6=CC=C5N7C[C@@H](C)C[C@H](N)C7)C8CC8
InChI
InChIKey=XNVZOGKOFKLWFQ-ABLBMNRKSA-N
InChI=1S/2C20H25N3O4.2C4H6O5.H2O/c2*1-11-7-12(21)9-22(8-11)16-6-5-14-17(19(16)27-2)23(13-3-4-13)10-15(18(14)24)20(25)26;2*5-2(4(8)9)1-3(6)7;/h2*5-6,10-13H,3-4,7-9,21H2,1-2H3,(H,25,26);2*2,5H,1H2,(H,6,7)(H,8,9);1H2/t2*11-,12-;;;/m00.../s1
| 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 | C20H25N3O4 |
| Molecular Weight | 371.4302 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C4H6O5 |
| Molecular Weight | 134.0874 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 03:08:14 UTC 2023
by
admin
on
Sat Dec 16 03:08:14 UTC 2023
|
| Record UNII |
Y97F3051FH
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Brand Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
DTXSID10241765
Created by
admin on Sat Dec 16 03:08:14 UTC 2023 , Edited by admin on Sat Dec 16 03:08:14 UTC 2023
|
PRIMARY | |||
|
951313-26-1
Created by
admin on Sat Dec 16 03:08:14 UTC 2023 , Edited by admin on Sat Dec 16 03:08:14 UTC 2023
|
PRIMARY | |||
|
Y97F3051FH
Created by
admin on Sat Dec 16 03:08:14 UTC 2023 , Edited by admin on Sat Dec 16 03:08:14 UTC 2023
|
PRIMARY | |||
|
71587894
Created by
admin on Sat Dec 16 03:08:14 UTC 2023 , Edited by admin on Sat Dec 16 03:08:14 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
|
|
PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ACTIVE MOIETY |