Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H19NO3.ClH.3H2O |
| Molecular Weight | 375.844 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.Cl.[H][C@]12C=C[C@H](O)[C@@H]3OC4=C5C(C[C@H]1NCC[C@@]235)=CC=C4OC
InChI
InChIKey=CELVQDHHUZWOEJ-PBHQHFOQSA-N
InChI=1S/C17H19NO3.ClH.3H2O/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16;;;;/h2-5,10-12,16,18-19H,6-8H2,1H3;1H;3*1H2/t10-,11+,12-,16-,17-;;;;/m0..../s1
| 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 | C17H19NO3 |
| Molecular Weight | 285.3377 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 15:39:47 UTC 2023
by
admin
on
Fri Dec 15 15:39:47 UTC 2023
|
| Record UNII |
YZQ36Z2XSM
|
| 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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70139214
Created by
admin on Fri Dec 15 15:39:47 UTC 2023 , Edited by admin on Fri Dec 15 15:39:47 UTC 2023
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PRIMARY | |||
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YZQ36Z2XSM
Created by
admin on Fri Dec 15 15:39:47 UTC 2023 , Edited by admin on Fri Dec 15 15:39:47 UTC 2023
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PRIMARY | |||
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6055-79-4
Created by
admin on Fri Dec 15 15:39:47 UTC 2023 , Edited by admin on Fri Dec 15 15:39:47 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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