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:78412 -
cis
-anethole
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
cis
-anethole
ChEBI ID
CHEBI:78412
ChEBI ASCII Name
cis-anethole
Definition
The
cis
-stereoisomer of anethole.
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
C10H12O
Net Charge
0
Average Mass
148.20170
Monoisotopic Mass
148.08882
InChI
InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3-
InChIKey
RUVINXPYWBROJD-ARJAWSKDSA-N
SMILES
COc1ccc(\C=C/C)cc1
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via
anethole
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cis
-anethole (
CHEBI:78412
)
is a
anethole (
CHEBI:2716
)
IUPAC Name
methyl 4-[(1
Z
)-prop-1-en-1-yl]phenyl ether
Synonym
Source
1-methoxy-4-[(1
Z
)-prop-1-en-1-yl]benzene
IUPAC
Registry Numbers
Types
Sources
1209632
Reaxys Registry Number
Reaxys
25679-28-1
CAS Registry Number
ChemIDplus
Last Modified
01 May 2014