Details
Stereochemistry | RACEMIC |
Molecular Formula | C18H23NO3.ClH |
Molecular Weight | 337.841 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(CCC1=CC=C(O)C=C1)NCCC2=CC(O)=C(O)C=C2
InChI
InChIKey=BQKADKWNRWCIJL-UHFFFAOYSA-N
InChI=1S/C18H23NO3.ClH/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15;/h4-9,12-13,19-22H,2-3,10-11H2,1H3;1H
Molecular Formula | C18H23NO3 |
Molecular Weight | 301.3801 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:29:56 UTC 2023
by
admin
on
Fri Dec 15 17:29:56 UTC 2023
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Record UNII |
0WR771DJXV
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C48149
Created by
admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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Code System | Code | Type | Description | ||
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4671
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256-464-1
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DTXSID30964383
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C28997
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0WR771DJXV
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49745-95-1
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DBSALT000711
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CHEMBL926
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m4710
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admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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PRIMARY | Merck Index | ||
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65324
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1224507
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0WR771DJXV
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admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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203121
Created by
admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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299583
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100000087521
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admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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SUB01803MIG
Created by
admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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52663-81-7
Created by
admin on Fri Dec 15 17:29:56 UTC 2023 , Edited by admin on Fri Dec 15 17:29:56 UTC 2023
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SUPERSEDED |
Related Record | Type | Details | ||
---|---|---|---|---|
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BASIS OF STRENGTH->SUBSTANCE |
ASSAY (TITRATION)
EP
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||
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ENANTIOMER -> RACEMATE | |||
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BASIS OF STRENGTH->SUBSTANCE |
ASSAY (HPLC)
USP
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||
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ENANTIOMER -> RACEMATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
---|---|---|---|---|
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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||
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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Related Record | Type | Details | ||
---|---|---|---|---|
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ACTIVE MOIETY |