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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:5964 - iridodial
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ChEBI Ontology
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ChEBI Name
iridodial
ChEBI ID
CHEBI:5964
Definition
A dialdehyde that is cyclopentanecarbaldehyde substituted by a methyl group at position 2 and a 1-methyl-2-oxoethyl group at position 5.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H16O2
Net Charge
0
Average Mass
168.23284
Monoisotopic Mass
168.11503
InChI
InChI=1S/C10H16O2/c1-7-3-4-9(8(2)5-11)10(7)6-12/h5-10H,3-4H2,1-2H3
InChIKey
HMCYXRFNNOPPPR-UHFFFAOYSA-N
SMILES
CC1CCC(C(C)C=O)C1C=O
ChEBI Ontology
Outgoing
iridodial (
CHEBI:5964
)
is a
dialdehyde (
CHEBI:38124
)
iridodial (
CHEBI:5964
)
is a
iridoid monoterpenoid (
CHEBI:50563
)
Incoming
(+)-iridodial (
CHEBI:25
)
is a
iridodial (
CHEBI:5964
)
IUPAC Name
2-methyl-5-(1-methyl-2-oxoethyl)cyclopentanecarbaldehyde
Synonym
Source
Iridodial
KEGG COMPOUND
Manual Xrefs
Databases
C06069
KEGG COMPOUND
LMPR0102070003
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
2042496
Reaxys Registry Number
Reaxys
2042496
Beilstein Registry Number
Beilstein
Citations
Types
Sources
23202979
PubMed citation
Europe PMC
25578278
PubMed citation
Europe PMC
Last Modified
22 January 2015