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> Main
CHEBI:43619 - icosane
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ChEBI Name
icosane
ChEBI ID
CHEBI:43619
Definition
A straight chain alkane composed of 20 carbon atoms. It has been isolated from the leaves of
Agave attenuata
.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:43618, CHEBI:32929
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Formula
C20H42
Net Charge
0
Average Mass
282.54748
Monoisotopic Mass
282.32865
InChI
InChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3
InChIKey
CBFCDTFDPHXCNY-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCCCCCC
Metabolite of Species
Details
Agave attenuata
(NCBI:txid39511)
See:
PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
icosane (
CHEBI:43619
)
has role
plant metabolite (
CHEBI:76924
)
icosane (
CHEBI:43619
)
is a
long-chain alkane (
CHEBI:83563
)
Incoming
2-aminoicosane-1,3-diol (
CHEBI:64907
)
has functional parent
icosane (
CHEBI:43619
)
1,2-icosanediol (
CHEBI:84957
)
has parent hydride
icosane (
CHEBI:43619
)
2-amino-1,3,4,5-icosanetetrol (
CHEBI:131749
)
has parent hydride
icosane (
CHEBI:43619
)
5,7-icosanedione (
CHEBI:134475
)
has parent hydride
icosane (
CHEBI:43619
)
6,8-icosanedione (
CHEBI:134474
)
has parent hydride
icosane (
CHEBI:43619
)
fumonisin (
CHEBI:38224
)
has parent hydride
icosane (
CHEBI:43619
)
icosanedioic acid (
CHEBI:73728
)
has parent hydride
icosane (
CHEBI:43619
)
icosanol (
CHEBI:197480
)
has parent hydride
icosane (
CHEBI:43619
)
arachidyl group (
CHEBI:32930
)
is substituent group from
icosane (
CHEBI:43619
)
IUPAC Name
icosane
Synonyms
Sources
CH
3
‒[CH
2
]
18
‒CH
3
IUPAC
eicosane
NIST Chemistry WebBook
EICOSANE
PDBeChem
n
-eicosane
NIST Chemistry WebBook
octyldodecane
ChEBI
Manual Xrefs
Databases
HMDB0059909
HMDB
Icosane
Wikipedia
LFA
PDBeChem
View more database links
Registry Numbers
Types
Sources
112-95-8
CAS Registry Number
NIST Chemistry WebBook
112-95-8
CAS Registry Number
ChemIDplus
1700722
Beilstein Registry Number
Beilstein
1700722
Reaxys Registry Number
Reaxys
Citations
Types
Sources
23459067
PubMed citation
Europe PMC
23880873
PubMed citation
Europe PMC
23899195
PubMed citation
Europe PMC
Last Modified
23 October 2023