Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12CC[C@@]([H])(N1C)C(=CC2)C(=O)OC
InChI
InChIKey=MPSNEAHFGOEKBI-VXNVDRBHSA-N
InChI=1S/C10H15NO2/c1-11-7-3-5-8(10(12)13-2)9(11)6-4-7/h5,7,9H,3-4,6H2,1-2H3/t7-,9-/m1/s1
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Examination of postmortem fluids and tissues for the presence of methylecgonidine, ecgonidine, cocaine, and benzoylecgonine using solid-phase extraction and gas chromatography-mass spectrometry. | 2001 Jun |
|
| Studies on in vitro degradation of anhydroecgonine methyl ester (methylecgonidine) in human plasma. | 2002 Nov-Dec |
|
| Determination of the dermal penetration of esterom components using microdialysis sampling. | 2003 Nov |
|
| Two- and three dimensional combinatorial chemistry from multicomponent Grignard reagents. | 2004 Jul-Aug |
|
| Concentration profiles of cocaine, pyrolytic methyl ecgonidine and thirteen metabolites in human blood and urine: determination by gas chromatography-mass spectrometry. | 2005 Nov |
Patents
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:45:31 UTC 2023
by
admin
on
Fri Dec 15 15:45:31 UTC 2023
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| Record UNII |
58C337KP3E
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| Record Status |
Validated (UNII)
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| Record Version |
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43021-26-7
Created by
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119478
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admin on Fri Dec 15 15:45:31 UTC 2023 , Edited by admin on Fri Dec 15 15:45:31 UTC 2023
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58C337KP3E
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Methylecgonidine
Created by
admin on Fri Dec 15 15:45:31 UTC 2023 , Edited by admin on Fri Dec 15 15:45:31 UTC 2023
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PRIMARY | Methylecgonidine is a pyrolysis product formed when crack cocaine is smoked, making this substance a useful biomarker to specifically test for use of crack cocaine, as opposed to powder cocaine which does not form methylecgonidine as a metabolite. | ||
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m4809
Created by
admin on Fri Dec 15 15:45:31 UTC 2023 , Edited by admin on Fri Dec 15 15:45:31 UTC 2023
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PRIMARY | Merck Index | ||
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DTXSID20276220
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