Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H27N3O4.H2O |
Molecular Weight | 415.4828 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O=C(NC1=CC=CC=C1)OC[C@@H](CN2CCCCC2)OC(=O)NC3=CC=CC=C3
InChI
InChIKey=DUEYECWLQOUBNL-VEIFNGETSA-N
InChI=1S/C22H27N3O4.H2O/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19;/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27);1H2/t20-;/m1./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 | C22H27N3O4 |
Molecular Weight | 397.4675 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:08:43 GMT 2023
by
admin
on
Sat Dec 16 11:08:43 GMT 2023
|
Record UNII |
10W904FL2C
|
Record Status |
Validated (UNII)
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Record Version |
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-
Download
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Systematic Name | English |
Code System | Code | Type | Description | ||
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76969481
Created by
admin on Sat Dec 16 11:08:43 GMT 2023 , Edited by admin on Sat Dec 16 11:08:43 GMT 2023
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PRIMARY | |||
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10W904FL2C
Created by
admin on Sat Dec 16 11:08:43 GMT 2023 , Edited by admin on Sat Dec 16 11:08:43 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
RACEMATE -> ENANTIOMER | |||
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ANHYDROUS->SOLVATE |