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ChEBI
> Main
CHEBI:28897 - pentadecane
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ChEBI Ontology
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ChEBI Name
pentadecane
ChEBI ID
CHEBI:28897
Definition
A straight-chain alkane with 15 carbon atoms. It is a component of volatile oils isolated from plants species like
Scandix balansae
.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:44175, CHEBI:7973, CHEBI:25466
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Formula
C15H32
Net Charge
0
Average Mass
212.41458
Monoisotopic Mass
212.25040
InChI
InChI=1S/C15H32/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-15H2,1-2H3
InChIKey
YCOZIPAWZNQLMR-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCC
Metabolite of Species
Details
Scandix balansae
(NCBI:txid54832)
See:
PubMed
Roles Classification
Biological Role
(s):
animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
pentadecane (
CHEBI:28897
)
has role
animal metabolite (
CHEBI:75767
)
pentadecane (
CHEBI:28897
)
has role
plant metabolite (
CHEBI:76924
)
pentadecane (
CHEBI:28897
)
has role
volatile oil component (
CHEBI:27311
)
pentadecane (
CHEBI:28897
)
is a
long-chain alkane (
CHEBI:83563
)
Incoming
14-methylpentadecan-1-ol (
CHEBI:84910
)
has parent hydride
pentadecane (
CHEBI:28897
)
pentadecanol (
CHEBI:195629
)
has parent hydride
pentadecane (
CHEBI:28897
)
pentadecyl group (
CHEBI:32909
)
is substituent group from
pentadecane (
CHEBI:28897
)
Synonyms
Sources
CH
3
‒[CH
2
]
13
‒CH
3
IUPAC
n-Pentadecane
KEGG COMPOUND
Pentadecane
KEGG COMPOUND
PENTADECANE
PDBeChem
pentadecane
UniProt
Pentadekan
ChEBI
Manual Xrefs
Databases
C00001265
KNApSAcK
C08388
KEGG COMPOUND
CPD-7946
MetaCyc
DB03715
DrugBank
HMDB0059886
HMDB
LMFA11000006
LIPID MAPS
MYS
PDBeChem
Pentadecane
Wikipedia
View more database links
Registry Numbers
Types
Sources
1698194
Reaxys Registry Number
Reaxys
1698194
Beilstein Registry Number
ChemIDplus
629-62-9
CAS Registry Number
KEGG COMPOUND
629-62-9
CAS Registry Number
ChemIDplus
629-62-9
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
14598162
PubMed citation
Europe PMC
15330541
PubMed citation
Europe PMC
23847066
PubMed citation
Europe PMC
23973758
PubMed citation
Europe PMC
Last Modified
25 August 2023