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(Q77568195)
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English
(9S,13S)-1a,1b-dihomo-jasmonic acid
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
4-(3-Oxo-2-pent-2-enylcyclopentyl)butanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
238.156894564
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(9R,13R)-1a,1b-dihomo-jasmonic acid
1 reference
based on heuristic
inferred from InChI
(1S,2R)-3-oxo-2-(2Z-pentenyl)cyclopentane-1-butyric acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₂₂O₃
0 references
canonical SMILES
O=C(O)CCCC1CCC(=O)C1CC=CCC
0 references
isomeric SMILES
CC/C=C\C[C@H]1[C@H](CCC1=O)CCCC(=O)O
0 references
found in taxon
Lasiodiplodia theobromae
2 references
stated in
Metabolites of Lasiodiplodia theobromae
stated in
Jasmonic acid-like substances from the culture filtrate of Botryodiplodia theobromae
Fusarium oxysporum
2 references
stated in
Jasmonates and related compounds from Fusarium oxysporum
stated in
Jasmonates and related compounds from Fusarium oxysporum
Identifiers
InChI
InChI=1S/C14H22O3/c1-2-3-4-7-12-11(9-10-13(12)15)6-5-8-14(16)17/h3-4,11-12H,2,5-10H2,1H3,(H,16,17)/b4-3-/t11-,12-/m0/s1
0 references
InChIKey
LVQJNKFFJNUFNY-WGPFEIJOSA-N
2 references
stated in
PubChem
PubChem CID
14311116
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
14311116
language of work or name
English
PubChem CID
14311116
2 references
stated in
PubChem
PubChem CID
14311116
language of work or name
English
matched by identifier from
InChIKey
InChIKey
LVQJNKFFJNUFNY-WGPFEIJOSA-N
ChEBI ID
184237
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C14H22O3/c1-2-3-4-7-12-11(9-10-13(12)15)6-5-8-14(16)17/h3-4,11-12H,2,5-10H2,1H3,(H,16,17)/b4-3-/t11-,12-/m0/s1
UniChem compound ID
46062421
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA015924
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LVQJNKFFJNUFNY-WGPFEIJOSA-N
LIPID MAPS ID
LMFA02010011
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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