Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C10H17NO3.ClH |
| Molecular Weight | 235.708 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1O)N2C
InChI
InChIKey=RLLMNWXOZDXKCQ-NPPHLGRCSA-N
InChI=1S/C10H17NO3.ClH/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2;/h6-9,12H,3-5H2,1-2H3;1H/t6-,7+,8-,9+;/m0./s1
| Molecular Formula | C10H17NO3 |
| Molecular Weight | 199.2469 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| 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
PubMed
| Title | Date | PubMed |
|---|---|---|
| 2'-substituted analogs of cocaine: synthesis and dopamine transporter binding potencies. | 2001 Sep |
|
| Analysis of cocaine, benzoylecgonine, ecogonine methyl ester, and ecgonine by high-pressure liquid chromatography-API mass spectrometry and application to a short-term degradation study of cocaine in plasma. | 2001 Sep |
|
| Determination of the highest no-effect dose (HNED) and of the elimination pattern for cocaine in horses. | 2002 Mar-Apr |
|
| Determination of the dermal penetration of esterom components using microdialysis sampling. | 2003 Nov |
|
| Three-dimensional quantitative structure-activity relationship modeling of cocaine binding by a novel human monoclonal antibody. | 2004 Jan 1 |
|
| Rapid analysis of benzoylecgonine in urine by fast gas chromatography-mass spectrometry. | 2006 Oct |
|
| Bioanalytical procedures for determination of drugs of abuse in blood. | 2007 Aug |
|
| Application of discriminant analysis to differentiate between incorporation of cocaine and its congeners into hair and contamination. | 2008 Mar 21 |
|
| Using molecular similarity to highlight the challenges of routine immunoassay-based drug of abuse/toxicology screening in emergency medicine. | 2009 Apr 28 |
|
| The hydrated and anhydrous gold(III) tetrachloride salts of L-ecgonine, an important forensic toxicology marker for cocaine. | 2010 Jan |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:54:08 GMT 2023
by
admin
on
Fri Dec 15 15:54:08 GMT 2023
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| Record UNII |
VY81V42YYZ
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| Record Status |
Validated (UNII)
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| Record Version |
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162352
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DTXSID10959818
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38969-40-3
Created by
admin on Fri Dec 15 15:54:08 GMT 2023 , Edited by admin on Fri Dec 15 15:54:08 GMT 2023
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VY81V42YYZ
Created by
admin on Fri Dec 15 15:54:08 GMT 2023 , Edited by admin on Fri Dec 15 15:54:08 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
APPROXIMATE PURE ANHYDROUS DRUG CONTENT (IN PERCENT)
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SALT/SOLVATE -> PARENT | |||
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PARENT -> SALT/SOLVATE |
