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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
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CHEBI:8916 - Ruspolinone
Main
ChEBI Ontology
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ChEBI Name
Ruspolinone
ChEBI ID
CHEBI:8916
Stars
This entity has been manually annotated by a third party.
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Formula
C14H19NO3
Net Charge
0
Average Mass
249.306
Monoisotopic Mass
249.13649
InChI
InChI=1S/C14H19NO3/c1-17-13-6-5-10(8-14(13)18-2)12(16)9-11-4-3-7-15-11/h5-6,8,11,15H,3-4,7,9H2,1-2H3
InChIKey
TYXKSMFICLVQCO-UHFFFAOYSA-N
SMILES
COc1ccc(cc1OC)C(=O)CC1CCCN1
ChEBI Ontology
Outgoing
Ruspolinone (
CHEBI:8916
)
is a
acetophenones (
CHEBI:22187
)
Synonym
Source
Ruspolinone
KEGG COMPOUND
Manual Xrefs
Databases
C00002070
KNApSAcK
C10169
KEGG COMPOUND
View more database links
Registry Number
Type
Source
60890-27-9
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014