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(Q81976382)
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English
3,7-Dimethylocta-2,6-dien-1-yl butanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyloctane monoterpenoid
0 references
biogenic acyclic ester
0 references
mass
224.177630008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₂₄O₂
0 references
canonical SMILES
O=C(OCC=C(C)CCC=C(C)C)CCC
0 references
found in taxon
Thymus camphoratus
1 reference
stated in
Composition and infraspecific variability of essential oil from Thymus camphoratus
Mangifera indica
1 reference
stated in
Physico-chemical and antioxidant properties of four mango (Mangifera indica L.) cultivars in China
Cymbopogon citratus
1 reference
stated in
GC-MS evaluation of Cymbopogon citratus (DC) Stapf oil obtained using modified hydrodistillation and microwave extraction methods
Identifiers
InChI
InChI=1S/C14H24O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,10H,5-7,9,11H2,1-4H3
0 references
InChIKey
ZSBOMYJPSRFZAL-UHFFFAOYSA-N
0 references
CAS Registry Number
2173-82-2
0 references
PubChem CID
7796
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ZSBOMYJPSRFZAL-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL118466
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZSBOMYJPSRFZAL-UHFFFAOYSA-N
UniChem compound ID
25758805
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID7047225
1 reference
matched by identifier from
InChIKey
InChIKey
ZSBOMYJPSRFZAL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID5027225
0 references
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