Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:86548 - 3,4-dimethoxy cinnamaldehyde
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
3,4-dimethoxy cinnamaldehyde
ChEBI ID
CHEBI:86548
Definition
A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by methoxy groups at positions 3' and 4' respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C11H12O3
Net Charge
0
Average Mass
192.21120
Monoisotopic Mass
192.07864
InChI
InChI=1S/C11H12O3/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h3-8H,1-2H3/b4-3+
InChIKey
KNUFNLWDGZQKKJ-ONEGZZNKSA-N
SMILES
COc1ccc(\C=C\C=O)cc1OC
ChEBI Ontology
Outgoing
3,4-dimethoxy cinnamaldehyde (
CHEBI:86548
)
has functional parent
(
E
)-cinnamaldehyde (
CHEBI:16731
)
3,4-dimethoxy cinnamaldehyde (
CHEBI:86548
)
is a
cinnamaldehydes (
CHEBI:23245
)
3,4-dimethoxy cinnamaldehyde (
CHEBI:86548
)
is a
dimethoxybenzene (
CHEBI:51681
)
IUPAC Name
(2
E
)-3-(3,4-dimethoxyphenyl)prop-2-enal
Synonyms
Sources
trans
-3,4-dimethoxycinnamaldehyde
ChEBI
trans
-3-(3,4-dimethoxyphenyl)-2-propenaldehyde
ChEBI
Registry Number
Type
Source
2504527
Reaxys Registry Number
Reaxys
Last Modified
20 July 2015