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(Q76305252)
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English
(E)-oct-3-en-1-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
fatty alcohol
0 references
mass
128.120115132
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₆O
0 references
canonical SMILES
OCCC=CCCCC
0 references
isomeric SMILES
CCCC/C=C/CCO
0 references
found in taxon
Laggera alata
1 reference
stated in
6-Hydroxycarvotanacetone and other constituents of the essential oil ofLaggera alata (D. Don) Sch. Bip. ex Oliv.
Malpighia punicifolia
1 reference
stated in
Chemical composition of acerola fruit (Malpighia punicifolia L.) at three stages of maturity
Rosmarinus officinalis
1 reference
stated in
Essential Oil of Rosemary(Rosmarinus officinalisL.) from Cuba
Malpighia glabra
1 reference
stated in
Chemical composition of acerola fruit (Malpighia punicifolia L.) at three stages of maturity
Malpighia emarginata
1 reference
stated in
Chemical composition of acerola fruit (Malpighia punicifolia L.) at three stages of maturity
Vergonis planta
1 reference
stated in
The chemistry of food flavour. I. Volatile constituents of passionfruit, Passiflora edulis
Matsutake
1 reference
stated in
Volatile flavor compounds of Matsutake-Tricholomam atsutake (Ito et Imai) Sing.
Identifiers
InChI
InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h5-6,9H,2-4,7-8H2,1H3/b6-5+
0 references
InChIKey
YDXQPTHHAPCTPP-AATRIKPKSA-N
0 references
CAS Registry Number
20125-85-3
1 reference
InChIKey
YDXQPTHHAPCTPP-AATRIKPKSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=20125-85-3
PubChem CID
5364475
1 reference
matched by identifier from
InChIKey
InChIKey
YDXQPTHHAPCTPP-AATRIKPKSA-N
ChEBI ID
168692
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h5-6,9H,2-4,7-8H2,1H3/b6-5+
SureChEMBL ID
SCHEMBL1129182
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDXQPTHHAPCTPP-AATRIKPKSA-N
UniChem compound ID
23725052
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40885116
1 reference
matched by identifier from
InChIKey
InChIKey
YDXQPTHHAPCTPP-AATRIKPKSA-N
DSSTOX compound identifier
DTXCID30211349
0 references
Human Metabolome Database ID
HMDB0035768
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDXQPTHHAPCTPP-AATRIKPKSA-N
LIPID MAPS ID
LMFA05000560
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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