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jasmonate

MNXM819642 is deprecated and replaced by MNXM733252
PropertiesImage
MNX_IDMNXM733252 Image of MNXM733252
referencechebi:58431
formulaC12H17O3
global charge-1
mol weight209.265
InChIKeyZNJFBWYDHIGLCU-HWKXXFMVSA-M
InChIInChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/p-1/b4-3-/t9-,10-/m1/s1
SMILESCC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3-/t9-,10-/m1/s1 Image of MNXM733252
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:4]\[CH2:5][C@@H:10]1[C@@H:9]([CH2:8][C:12](=[O:14])[OH:15])[CH2:6][CH2:7][C:11]1=[O:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)17
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58431
chebi:58431
ZNJFBWYDHIGLCU-HWKXXFMVSA-M 		jasmonate
jasmonate(1-)
{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate

kegg.compound:C08491
keggC:C08491
ZNJFBWYDHIGLCU-HWKXXFMVSA-N 		(-)-Jasmonic acid
(-)-Jasmonate
Jasmonate
Jasmonic acid
{(1R,2R)-3-Oxo-2-[(Z)pent-2-enyl]cyclopent-2-enyl}acetic acid

sabiork.compound:10583
sabiorkM:10583
ZNJFBWYDHIGLCU-HWKXXFMVSA-N 		(-)-Jasmonic acid
Jasmonate
Jasmonic acid
{(1R,2R)-3-Oxo-2-[(Z)pent-2-enyl]cyclopent-2-enyl}acetic acid

metacyc.compound:CPD-734
metacycM:CPD-734
ZNJFBWYDHIGLCU-HWKXXFMVSA-M 		(-)-jasmonate
(-)-jasmonic acid
(3R,7R)-(-)-jasmonate
jasmonic acid
{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate

seed.compound:cpd05399
seedM:cpd05399
ZNJFBWYDHIGLCU-HWKXXFMVSA-M 		Jasmonate
(-)-Jasmonic acid
(-)-jasmonate
(-)-jasmonic acid
(3R,7R)-(-)-jasmonate
Jasmonic acid
jasmonic acid
{(1R,2R)-3-Oxo-2-[(Z)pent-2-enyl]cyclopent-2-enyl}acetic acid
{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate
hmdb:HMDB0032797
ZNJFBWYDHIGLCU-HWKXXFMVSA-N 		Jasmonic acid
(-)-Jasmonate
(-)-Jasmonic acid
(1R,2R)-3-Oxo-2-(2Z)-2-penten-1-ylcyclopentaneacetic acid
(1R,2R)-3-Oxo-2-(2Z)-2-pentenyl-cyclopentaneacetic acid
(1R,2R)-3-oxo-2-(2Z)-2-Penten-ylcyclopentanacetate
(1R,2R)-3-oxo-2-(2Z)-2-Penten-ylcyclopentanacetic acid
(1R,2R)-3-oxo-2-(Pent-2Z-enyl)-cyclopentaneacetate
(1R,2R)-3-oxo-2-(Pent-2Z-enyl)-cyclopentaneacetic acid
(1R,2R)-Jasmonic acid
(3R,7R)(-)-Jasmonic acid
(Z)-trans-3-Oxo-2-(2-pentenyl)-cyclopentaneacetic acid
2-[(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl]acetic acid
2-{(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl}acetate
2-{(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl}acetic acid
7-Epi-jasmonic acid
JA
Jasmonate
[1R-[1alpha,2beta(Z)]]-3-Oxo-2-(2-pentenyl)-cyclopentaneacetic acid
jasmonic acid
{(1R,2R)-3-oxo-2-[(Z)pent-2-enyl]cyclopent-2-enyl}acetate
{(1R,2R)-3-oxo-2-[(Z)pent-2-enyl]cyclopent-2-enyl}acetic acid

lipidmaps:LMFA02020001
lipidmapsM:LMFA02020001
ZNJFBWYDHIGLCU-HWKXXFMVSA-N 		Jasmonic acid
(-)-Jasmonic acid
(1R,2R)-3-oxo-2-(pent-2Z-enyl)-cyclopentaneacetic acid
(3R,7R)-Jasmonic acid
FA 12:3
O

SLM:000597971
slm:000597971
ZNJFBWYDHIGLCU-HWKXXFMVSA-M 		jasmonate

CHEBI:18292
chebi:18292
ZNJFBWYDHIGLCU-HWKXXFMVSA-N 		jasmonic acid
(-)-Jasmonic acid
(-)-jasmonic acid
(1R,2R)-3-oxo-2-(2Z)-2-penten-ylcyclopentanacetic acid
(1R,2R)-3-oxo-2-(pent-2Z-enyl)-cyclopentaneacetic acid
2-{(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl}acetate
Jasmonate
Jasmonic acid
{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid

hmdb:HMDB32797
chebi:14486
chebi:18487
chebi:95
keggC:M_C08491
seedM:M_cpd05399 		secondary/obsolete/fantasy identifier