Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C12H19NO3.ClH |
Molecular Weight | 261.745 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(C)NC[C@H](O)COC1=CC=C(O)C=C1
InChI
InChIKey=WDXYIFGETVGLBZ-MERQFXBCSA-N
InChI=1S/C12H19NO3.ClH/c1-9(2)13-7-11(15)8-16-12-5-3-10(14)4-6-12;/h3-6,9,11,13-15H,7-8H2,1-2H3;1H/t11-;/m0./s1
Molecular Formula | C12H19NO3 |
Molecular Weight | 225.2842 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
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 05:44:11 UTC 2023
by
admin
on
Sat Dec 16 05:44:11 UTC 2023
|
Record UNII |
U6VH18LCQ8
|
Record Status |
Validated (UNII)
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Record Version |
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-
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CHEMBL1160714
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admin on Sat Dec 16 05:44:11 UTC 2023 , Edited by admin on Sat Dec 16 05:44:11 UTC 2023
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DTXSID40210161
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61260-05-7
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admin on Sat Dec 16 05:44:11 UTC 2023 , Edited by admin on Sat Dec 16 05:44:11 UTC 2023
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100000085077
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SUB04029MIG
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43590
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U6VH18LCQ8
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262-676-5
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admin on Sat Dec 16 05:44:11 UTC 2023 , Edited by admin on Sat Dec 16 05:44:11 UTC 2023
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m9123
Created by
admin on Sat Dec 16 05:44:11 UTC 2023 , Edited by admin on Sat Dec 16 05:44:11 UTC 2023
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PRIMARY | Merck Index | ||
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C170344
Created by
admin on Sat Dec 16 05:44:11 UTC 2023 , Edited by admin on Sat Dec 16 05:44:11 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |