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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:139300 - (+)-jasmonic acid
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ChEBI Name
(+)-jasmonic acid
ChEBI ID
CHEBI:139300
Definition
An oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2
Z
)-pent-2-en-1-yl group at position 2 of the cyclopentane ring.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C12H18O3
Net Charge
0
Average Mass
210.270
Monoisotopic Mass
210.12559
InChI
InChI=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)
/b4-
3-
/t9-
,10-
/m0/s1
InChIKey
ZNJFBWYDHIGLCU-CMIOBCHKSA-N
SMILES
C(=O)(O)C[C@H]1[C@@H](C(CC1)=O)C/C=C\CC
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
jasmonates
The jasmonates (JAs) are a group of plant hormones which help regulate plant growth and development.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(+)-jasmonic acid (
CHEBI:139300
)
has role
jasmonates (
CHEBI:24937
)
(+)-jasmonic acid (
CHEBI:139300
)
is a
cyclopentanones (
CHEBI:36140
)
(+)-jasmonic acid (
CHEBI:139300
)
is a
oxo monocarboxylic acid (
CHEBI:35871
)
(+)-jasmonic acid (
CHEBI:139300
)
is conjugate acid of
(+)-jasmonic acid anion (
CHEBI:138625
)
(+)-jasmonic acid (
CHEBI:139300
)
is enantiomer of
jasmonic acid (
CHEBI:18292
)
Incoming
(+)-jasmonic acid anion (
CHEBI:138625
)
is conjugate base of
(+)-jasmonic acid (
CHEBI:139300
)
jasmonic acid (
CHEBI:18292
)
is enantiomer of
(+)-jasmonic acid (
CHEBI:139300
)
IUPAC Name
{(1
S
,2
S
)-3-oxo-2-[(2
Z
)-pent-2-en-1-yl]cyclopentyl}acetic acid
Synonym
Source
(1
S
,2
S
)-jasmonic acid
ChEBI
Registry Number
Type
Source
2415413
Reaxys Registry Number
Reaxys
Last Modified
14 December 2017