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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H14N2O2.ClH
Molecular Weight 254.713
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl L-tryptophanate hydrochloride

SMILES

Cl.COC(=O)[C@@H](N)CC1=CNC2=CC=CC=C12

InChI

InChIKey=XNFNGGQRDXFYMM-PPHPATTJSA-N
InChI=1S/C12H14N2O2.ClH/c1-16-12(15)10(13)6-8-7-14-11-5-3-2-4-9(8)11;/h2-5,7,10,14H,6,13H2,1H3;1H/t10-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C12H14N2O2
Molecular Weight 218.2518
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

PubMed

PubMed

TitleDatePubMed
Stereochemistry and mechanism of reactions catalyzed by indolyl-3-alkane alpha-hydroxylase.
1979 Jul 25
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:52:06 GMT 2023
Edited
by admin
on Sat Dec 16 01:52:06 GMT 2023
Record UNII
AU62O6861L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl L-tryptophanate hydrochloride
Systematic Name English
L-Tryptophan, methyl ester, hydrochloride (1:1)
Systematic Name English
Methyl Tryptophanate HCl
INCI  
INCI  
Official Name English
(S)-Tryptophan methyl ester monohydrochloride
Systematic Name English
Methyl Tryptophanate HCl [INCI]
Common Name English
Code System Code Type Description
CAS
7524-52-9
Created by admin on Sat Dec 16 01:52:06 GMT 2023 , Edited by admin on Sat Dec 16 01:52:06 GMT 2023
PRIMARY
PUBCHEM
2734891
Created by admin on Sat Dec 16 01:52:06 GMT 2023 , Edited by admin on Sat Dec 16 01:52:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID10226219
Created by admin on Sat Dec 16 01:52:06 GMT 2023 , Edited by admin on Sat Dec 16 01:52:06 GMT 2023
PRIMARY
FDA UNII
AU62O6861L
Created by admin on Sat Dec 16 01:52:06 GMT 2023 , Edited by admin on Sat Dec 16 01:52:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
231-385-5
Created by admin on Sat Dec 16 01:52:06 GMT 2023 , Edited by admin on Sat Dec 16 01:52:06 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
PARENT -> SALT/SOLVATE