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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19NO2.ClH
Molecular Weight 257.756
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARNEGINE HYDROCHLORIDE, (S)-

SMILES

Cl.COC1=C(OC)C=C2[C@H](C)N(C)CCC2=C1

InChI

InChIKey=LARXMHOYLNCTFD-FVGYRXGTSA-N
InChI=1S/C13H19NO2.ClH/c1-9-11-8-13(16-4)12(15-3)7-10(11)5-6-14(9)2;/h7-9H,5-6H2,1-4H3;1H/t9-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C13H19NO2
Molecular Weight 221.2955
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
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

Substance Class Chemical
Created
by admin
on Wed Apr 02 13:26:33 GMT 2025
Edited
by admin
on Wed Apr 02 13:26:33 GMT 2025
Record UNII
NRH3531R31
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(-)-CARNEGINE HYDROCHLORIDE
Preferred Name English
CARNEGINE HYDROCHLORIDE, (S)-
Common Name English
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-1,2-DIMETHYL-, HYDROCHLORIDE (1:1), (1S)-
Systematic Name English
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-1,2-DIMETHYL-, HYDROCHLORIDE, (S)-
Systematic Name English
Code System Code Type Description
CAS
65140-22-9
Created by admin on Wed Apr 02 13:26:33 GMT 2025 , Edited by admin on Wed Apr 02 13:26:33 GMT 2025
PRIMARY
PUBCHEM
2752375
Created by admin on Wed Apr 02 13:26:33 GMT 2025 , Edited by admin on Wed Apr 02 13:26:33 GMT 2025
PRIMARY
FDA UNII
NRH3531R31
Created by admin on Wed Apr 02 13:26:33 GMT 2025 , Edited by admin on Wed Apr 02 13:26:33 GMT 2025
PRIMARY
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