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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H11NO2.ClH
Molecular Weight 189.639
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VANILLYLAMINE HYDROCHLORIDE

SMILES

Cl.COC1=CC(CN)=CC=C1O

InChI

InChIKey=PUDMGOSXPCMUJZ-UHFFFAOYSA-N
InChI=1S/C8H11NO2.ClH/c1-11-8-4-6(5-9)2-3-7(8)10;/h2-4,10H,5,9H2,1H3;1H

HIDE SMILES / InChI

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

Molecular Formula C8H11NO2
Molecular Weight 153.1784
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Methyl jasmonate modulated biotransformation of phenylpropanoids to vanillin related metabolites using Capsicum frutescens root cultures.
2005 Feb
A novel acylase from Streptomyces mobaraensis that efficiently catalyzes hydrolysis/synthesis of capsaicins as well as N-acyl-L-amino acids and N-acyl-peptides.
2006 Jan 11
Capsinoid is biosynthesized from phenylalanine and valine in a non-pungent pepper, Capsicum annuum L. cv. CH-19 sweet.
2006 Jun
In vitro hepatic and skin metabolism of capsaicin.
2008 Apr
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 15:19:43 UTC 2023
Edited
by admin
on Sat Dec 16 15:19:43 UTC 2023
Record UNII
YD97FX0LRF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VANILLYLAMINE HYDROCHLORIDE
Common Name English
4-AMINOMETHYL-2-METHOXYPHENOL HYDROCHLORIDE
Systematic Name English
NSC-62020
Code English
Code System Code Type Description
PUBCHEM
165576
Created by admin on Sat Dec 16 15:19:43 UTC 2023 , Edited by admin on Sat Dec 16 15:19:43 UTC 2023
PRIMARY
CAS
7149-10-2
Created by admin on Sat Dec 16 15:19:43 UTC 2023 , Edited by admin on Sat Dec 16 15:19:43 UTC 2023
PRIMARY
EPA CompTox
DTXSID70221705
Created by admin on Sat Dec 16 15:19:43 UTC 2023 , Edited by admin on Sat Dec 16 15:19:43 UTC 2023
PRIMARY
FDA UNII
YD97FX0LRF
Created by admin on Sat Dec 16 15:19:43 UTC 2023 , Edited by admin on Sat Dec 16 15:19:43 UTC 2023
PRIMARY
NSC
62020
Created by admin on Sat Dec 16 15:19:43 UTC 2023 , Edited by admin on Sat Dec 16 15:19:43 UTC 2023
PRIMARY
ECHA (EC/EINECS)
230-468-3
Created by admin on Sat Dec 16 15:19:43 UTC 2023 , Edited by admin on Sat Dec 16 15:19:43 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE