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(Q77495832)
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English
Dioctylketone
bioactive natural product
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default values for all languages
No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ketone
0 references
mass
254.260965708
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₃₄O
0 references
canonical SMILES
CCCCCCCCC(=O)CCCCCCCC
0 references
melting point
52.0
degree Celsius
1 reference
stated in
Jean-Claude Bradley Open Melting Point Dataset
found in taxon
Aspergillus ustus
1 reference
stated in
Nonpolar compounds and free fatty acids from marine fungi Aspergillus ustus
Tridax procumbens
1 reference
stated in
Lipid constituents of Tridax procumbens
Terminalia chebula
1 reference
stated in
Extraction, gas chromatography-mass spectrometry analysis and screening of fruits of Terminalia chebula Retz. for its antimicrobial potential
Identifiers
InChI
InChI=1S/C17H34O/c1-3-5-7-9-11-13-15-17(18)16-14-12-10-8-6-4-2/h3-16H2,1-2H3
0 references
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
10887
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10887
language of work or name
English
CAS Registry Number
540-08-9
1 reference
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=540-08-9
PubChem CID
10887
2 references
stated in
PubChem
PubChem CID
10887
language of work or name
English
matched by identifier from
InChIKey
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
ChEBI ID
213596
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H34O/c1-3-5-7-9-11-13-15-17(18)16-14-12-10-8-6-4-2/h3-16H2,1-2H3
SureChEMBL ID
SCHEMBL342685
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
UniChem compound ID
24348981
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50202310
1 reference
matched by identifier from
InChIKey
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50124801
0 references
NSC number
7336
0 references
UNII
KXL8T26JYS
1 reference
matched by identifier from
InChIKey
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
Natural Product Atlas ID
NPA010373
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WTJKUFMLQFLJOT-UHFFFAOYSA-N
LIPID MAPS ID
LMFA12000196
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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Wiktionary
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Multilingual sites
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