Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.7.1
Substance Class Chemical
Record UNII
CY9HK59OK6
Record Status Validated
Record Version
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Details

Stereochemistry RACEMIC
Molecular Formula C10H13NO
Molecular Weight 163.2163
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Created by admin on Wed Aug 04 11:42:08 EDT 2021
Edited by admin on Wed Aug 04 11:42:08 EDT 2021
Structure of 4-METHYLCATHINONE

Systematic Names:

  • None recorded

SMILES

CC(N)C(=O)C1=CC=C(C)C=C1

InChI

OHULHWHSUJEYIT-UHFFFAOYSA-N
InChI=1S/C10H13NO/c1-7-3-5-9(6-4-7)10(12)8(2)11/h3-6,8H,11H2,1-2H3
Name Type Language Details Access References
4-METHYLCATHINONE
Common Name
English  
PROPIOPHENONE, 2-AMINO-4'-METHYL-
Systematic Name
English  
NSC-60487
Code
English  
NORMEPHEDRONE
Common Name
English  
NOR-MEPHEDRONE
Common Name
English  
MEPHEDRONE METABOLITE M1
Common Name
English  
J3.321.826E
Code
English  
4-MC
Common Name
English  
2-AMINO-1-(4-METHYLPHENYL)-1-PROPANONE
Systematic Name
English  
1-PROPANONE, 2-AMINO-1-(4-METHYLPHENYL)-
Systematic Name
English  
Code System Code Type Description Access References
CAS
31952-47-3
Created by admin on Wed Aug 04 11:42:08 EDT 2021 , Edited by admin on Wed Aug 04 11:42:08 EDT 2021
PRIMARY
FDA UNII
CY9HK59OK6
Created by admin on Wed Aug 04 11:42:08 EDT 2021 , Edited by admin on Wed Aug 04 11:42:08 EDT 2021
PRIMARY
PUBCHEM
414532
Created by admin on Wed Aug 04 11:42:08 EDT 2021 , Edited by admin on Wed Aug 04 11:42:08 EDT 2021
PRIMARY
Related Record Type Details Access References
PARENT -> METABOLITE
Mediator Substance Details
none
IN VIVO
URINE
Created by admin on Wed Aug 04 11:42:08 EDT 2021 , Edited by admin on Wed Aug 04 11:42:08 EDT 2021
Created Wed Aug 04 11:42:08 EDT 2021
Created By admin
Last Edited Wed Aug 04 11:42:08 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 Pozo, Óscar J., et al. "Mass spectrometric evaluation of mephedrone in vivo human metabolism: identification of phase I and phase II metabolites, including a novel succinyl conjugate." Drug Metabolism and Disposition 43.2 (2015): 248-257. JA PUBLIC_DOMAIN_RELEASE
2 J Chromatogr A, 1397, 32-42 (2015) SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED
3 STN SRS NOMEN
4 https://en.wikipedia.org/wiki/4-Methylcathinone SRS NOMEN
5 STN STN (SCIFINDER)
6 SRS CODE IMPORT SRS NOMEN Fri Apr 28 15:11:02 EDT 2017
7 SciFinder SRS NOMEN
8 dump-public-2021-07-22_UPDATED.gsrs BATCH_IMPORT Wed Aug 04 11:42:08 EDT 2021
9 http://nikkajiweb.jst.go.jp/nikkaji_web/pages/top_e.jsp?CONTENT=syosai&SN=J3.321.826E SRS NOMEN
10 SRS import [CY9HK59OK6] SRS NOMEN Fri Apr 28 15:11:02 EDT 2017

Molecular Formula C10H13NO
Molecular Weight 163.2163
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )