Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H23NO3.ClH.2H2O |
Molecular Weight | 385.882 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.Cl.[H][C@@]12OC3=C4C(C[C@@]5([H])N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3OCC
InChI
InChIKey=FKEDUFRSQFFLHR-VSYPDCRNSA-N
InChI=1S/C19H23NO3.ClH.2H2O/c1-3-22-15-7-4-11-10-13-12-5-6-14(21)18-19(12,8-9-20(13)2)16(11)17(15)23-18;;;/h4-7,12-14,18,21H,3,8-10H2,1-2H3;1H;2*1H2/t12-,13+,14-,18-,19-;;;/m0.../s1
Molecular Formula | C19H23NO3 |
Molecular Weight | 313.3908 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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 |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:26:53 UTC 2023
by
admin
on
Fri Dec 15 17:26:53 UTC 2023
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Record UNII |
407X3NQV4N
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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 |
C67413
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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Code System | Code | Type | Description | ||
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m5154
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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PRIMARY | Merck Index | ||
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C87358
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admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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PRIMARY | |||
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DTXSID90986728
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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300000037439
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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PRIMARY | |||
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407X3NQV4N
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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5360215
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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6746-59-4
Created by
admin on Fri Dec 15 17:26:53 UTC 2023 , Edited by admin on Fri Dec 15 17:26:53 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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