U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H15NO2
Molecular Weight 181.2316
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-0-METHYL-.ALPHA.-METHYLDOPAMINE, (S)-

SMILES

COC1=CC(C[C@H](C)N)=CC=C1O

InChI

InChIKey=GPBOYXOSSQEJBH-ZETCQYMHSA-N
InChI=1S/C10H15NO2/c1-7(11)5-8-3-4-9(12)10(6-8)13-2/h3-4,6-7,12H,5,11H2,1-2H3/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H15NO2
Molecular Weight 181.2316
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 17:40:53 UTC 2019
Edited
by admin
on Tue Oct 22 17:40:53 UTC 2019
Record UNII
V193Z4145L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-0-METHYL-.ALPHA.-METHYLDOPAMINE, (S)-
Common Name English
PHENOL, 4-((2S)-2-AMINOPROPYL)-2-METHOXY-
Systematic Name English
PHENOL, 4-(2-AMINOPROPYL)-2-METHOXY-, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
7045778
Created by admin on Tue Oct 22 17:40:53 UTC 2019 , Edited by admin on Tue Oct 22 17:40:53 UTC 2019
PRIMARY
CAS
150200-03-6
Created by admin on Tue Oct 22 17:40:53 UTC 2019 , Edited by admin on Tue Oct 22 17:40:53 UTC 2019
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE
PARENT -> METABOLITE
URINE