Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H27N3O3.C4H4O4 |
| Molecular Weight | 473.5188 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
| Stereo Comments | MESO |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN1[C@H]2CC[C@@H]1C[C@@H](C2)NC(=O)NC(=O)C3=C(OCC4CC4)C=CC=C3
InChI
InChIKey=WSQXJOSWCXAIIL-VORWGQCMSA-N
InChI=1S/C20H27N3O3.C4H4O4/c1-23-15-8-9-16(23)11-14(10-15)21-20(25)22-19(24)17-4-2-3-5-18(17)26-12-13-6-7-13;5-3(6)1-2-4(7)8/h2-5,13-16H,6-12H2,1H3,(H2,21,22,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,15+,16-;
| Molecular Formula | C20H27N3O3 |
| Molecular Weight | 357.4467 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| StereoComments | MESO |
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:05:41 GMT 2025
by
admin
on
Mon Mar 31 18:05:41 GMT 2025
|
| Record UNII |
8RXE45NW24
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English | ||
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Code | English |
| Code System | Code | Type | Description | ||
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8RXE45NW24
Created by
admin on Mon Mar 31 18:05:41 GMT 2025 , Edited by admin on Mon Mar 31 18:05:41 GMT 2025
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PRIMARY | |||
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136013-70-2
Created by
admin on Mon Mar 31 18:05:41 GMT 2025 , Edited by admin on Mon Mar 31 18:05:41 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |