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(Q81993950)
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English
Ethyl tridecanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
242.2245802
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₃₀O₂
0 references
canonical SMILES
CCCCCCCCCCCCC(=O)OCC
0 references
found in taxon
Nepeta hindostana
1 reference
stated in
A triterpene acid from Nepeta hindostana
Houttuynia cordata
3 references
stated in
Variation in chemical composition and antibacterial activities of essential oils from two species of Houttuynia THUNB
stated in
Variation in chemical composition and antibacterial activities of essential oils from two species of Houttuynia THUNB
stated in
Tentative fingerprint-efficacy study of Houttuynia cordata injection in quality control of traditional Chinese medicine
Saussurea involucrata
1 reference
stated in
Components of the Essential Oil of Saussurea involucrata (Kar. et Kir.) ex Maxim
Mangifera indica
1 reference
stated in
Volatile components from mango (Mangifera indica L.) cultivars
Identifiers
InChI
InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-14-15(16)17-4-2/h3-14H2,1-2H3
0 references
InChIKey
QJYYMNOTJXIOBP-UHFFFAOYSA-N
0 references
CAS Registry Number
28267-29-0
1 reference
InChIKey
QJYYMNOTJXIOBP-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=28267-29-0
PubChem CID
119908
1 reference
matched by identifier from
InChIKey
InChIKey
QJYYMNOTJXIOBP-UHFFFAOYSA-N
ChEBI ID
172102
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-14-15(16)17-4-2/h3-14H2,1-2H3
UniChem compound ID
24293466
1 reference
stated in
UniChem
ZVG number
495473
0 references
DSSTox substance ID
DTXSID8067369
1 reference
matched by identifier from
InChIKey
InChIKey
QJYYMNOTJXIOBP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID0037786
0 references
Human Metabolome Database ID
HMDB0059833
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QJYYMNOTJXIOBP-UHFFFAOYSA-N
KNApSAcK ID
C00030224
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QJYYMNOTJXIOBP-UHFFFAOYSA-N
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