Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H21NO3.ClH.H2O |
| Molecular Weight | 353.84 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.[H][C@@]12OC3=C(OC)C=CC4=C3[C@@]15CCN(C)[C@H](C4)[C@]5([H])CCC2=O
InChI
InChIKey=LJJZQRHEDPNUDZ-RLWSFTDUSA-N
InChI=1S/C18H21NO3.ClH.H2O/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;;/h3,6,11-12,17H,4-5,7-9H2,1-2H3;1H;1H2/t11-,12+,17-,18-;;/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 | 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 | C18H21NO3 |
| Molecular Weight | 299.3642 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:44:26 UTC 2023
by
admin
on
Sat Dec 16 09:44:26 UTC 2023
|
| Record UNII |
229E1EUY20
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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229E1EUY20
Created by
admin on Sat Dec 16 09:44:26 UTC 2023 , Edited by admin on Sat Dec 16 09:44:26 UTC 2023
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PRIMARY | |||
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5965-14-0
Created by
admin on Sat Dec 16 09:44:26 UTC 2023 , Edited by admin on Sat Dec 16 09:44:26 UTC 2023
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5360112
Created by
admin on Sat Dec 16 09:44:26 UTC 2023 , Edited by admin on Sat Dec 16 09:44:26 UTC 2023
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DTXSID60975048
Created by
admin on Sat Dec 16 09:44:26 UTC 2023 , Edited by admin on Sat Dec 16 09:44:26 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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|
PARENT -> SALT/SOLVATE | |||
|
ANHYDROUS->SOLVATE |
