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:81488 - Isobergaptol
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
Isobergaptol
ChEBI ID
CHEBI:81488
Stars
This entity has been manually annotated by a third party.
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
C11H6O4
Net Charge
0
Average Mass
202.16290
Monoisotopic Mass
202.02661
InChI
InChI=1S/C11H6O4/c12-8-5-9-7(3-4-14-9)11-6(8)1-2-10(13)15-11/h1-5,12H
InChIKey
OOWBIFOFDYBTAE-UHFFFAOYSA-N
SMILES
Oc1cc2occc2c2oc(=O)ccc12
ChEBI Ontology
Outgoing
Isobergaptol (
CHEBI:81488
)
is a
furanocoumarin (
CHEBI:24128
)
Manual Xref
Database
C18084
KEGG COMPOUND
View more database links