Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H15NO2.ClH |
| Molecular Weight | 253.725 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@]12CCCCN1[C@H]3C[C@@]24OC(=O)C=C4C=C3
InChI
InChIKey=SMLPFGHXMCDFRC-CSTPHZADSA-N
InChI=1S/C13H15NO2.ClH/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11;/h4-5,7,10-11H,1-3,6,8H2;1H/t10-,11-,13+;/m1./s1
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.2637 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:48:25 UTC 2023
by
admin
on
Sat Dec 16 14:48:25 UTC 2023
|
| Record UNII |
2YR3TL4U06
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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113200-97-8
Created by
admin on Sat Dec 16 14:48:25 UTC 2023 , Edited by admin on Sat Dec 16 14:48:25 UTC 2023
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2YR3TL4U06
Created by
admin on Sat Dec 16 14:48:25 UTC 2023 , Edited by admin on Sat Dec 16 14:48:25 UTC 2023
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133082998
Created by
admin on Sat Dec 16 14:48:25 UTC 2023 , Edited by admin on Sat Dec 16 14:48:25 UTC 2023
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m9829
Created by
admin on Sat Dec 16 14:48:25 UTC 2023 , Edited by admin on Sat Dec 16 14:48:25 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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