Details
Stereochemistry | ACHIRAL |
Molecular Formula | C29H33ClN2O3.H2O |
Molecular Weight | 511.052 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.CN(C)C(=O)C(CC[N@+]1([O-])CC[C@](O)(CC1)C2=CC=C(Cl)C=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChIKey=MVMJRVIHTNVDRP-AYFKLSOTSA-N
InChI=1S/C29H33ClN2O3.H2O/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32(35)20-17-28(34,18-21-32)23-13-15-26(30)16-14-23;/h3-16,34H,17-22H2,1-2H3;1H2/t28-,32-;
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 | C29H33ClN2O3 |
Molecular Weight | 493.037 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:09:09 UTC 2023
by
admin
on
Sat Dec 16 05:09:09 UTC 2023
|
Record UNII |
H3VOT77DE1
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Common Name | English | ||
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Brand Name | English | ||
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Code | English |
Classification Tree | Code System | Code | ||
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WHO-VATC |
QA07DA05
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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WHO-ATC |
A07DA05
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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Code System | Code | Type | Description | ||
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DB14661
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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PRIMARY | |||
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SUB23349
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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PRIMARY | |||
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100000087599
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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PRIMARY | |||
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H3VOT77DE1
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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PRIMARY | |||
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CHEMBL2105114
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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PRIMARY | |||
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1600
Created by
admin on Sat Dec 16 05:09:09 UTC 2023 , Edited by admin on Sat Dec 16 05:09:09 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
Related Record | Type | Details | ||
---|---|---|---|---|
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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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 |