Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C18H27NO.ClH |
| Molecular Weight | 309.874 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC=CC(=C1)C2(CCCCC2)N3CCCCC3
InChI
InChIKey=MFBXZMQWSUHTBV-UHFFFAOYSA-N
InChI=1S/C18H27NO.ClH/c1-20-17-10-8-9-16(15-17)18(11-4-2-5-12-18)19-13-6-3-7-14-19;/h8-10,15H,2-7,11-14H2,1H3;1H
| Molecular Formula | C18H27NO |
| Molecular Weight | 273.4131 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL2094124 Sources: ncbi.nlm.nih.gov/pubmed/23527166 |
20.0 nM [Ki] | ||
Target ID: CHEMBL228 Sources: ncbi.nlm.nih.gov/pubmed/23527166 |
216.0 nM [Ki] | ||
Target ID: Q99720|||Q7Z653 Gene ID: 10280.0 Gene Symbol: SIGMAR1 Target Organism: Homo sapiens (Human) Sources: ncbi.nlm.nih.gov/pubmed/23527166 |
42.0 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:21:08 UTC 2023
by
admin
on
Sat Dec 16 15:21:08 UTC 2023
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| Record UNII |
XYJ344I3GQ
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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129318255
Created by
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91164-58-8
Created by
admin on Sat Dec 16 15:21:08 UTC 2023 , Edited by admin on Sat Dec 16 15:21:08 UTC 2023
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XYJ344I3GQ
Created by
admin on Sat Dec 16 15:21:08 UTC 2023 , Edited by admin on Sat Dec 16 15:21:08 UTC 2023
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PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |