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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:62433 - (
R
)-2-
trans
-abscisate
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ChEBI Name
(
R
)-2-
trans
-abscisate
ChEBI ID
CHEBI:62433
ChEBI ASCII Name
(R)-2-trans-abscisate
Definition
A 2-
trans
-abscisate obtained by removal of a proton from the carboxy group of (
R
)-2-trans-abscisic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C15H19O4
Net Charge
-1
Average Mass
263.30900
Monoisotopic Mass
263.12888
InChI
InChI=1S/C15H20O4/c1-
10(7-
13(17)
18)
5-
6-
15(19)
11(2)
8-
12(16)
9-
14(15,3)
4/h5-
8,19H,9H2,1-
4H3,(H,17,18)
/p-
1/b6-
5+,10-
7+/t15-
/m0/s1
InChIKey
JLIDBLDQVAYHNE-XQFZKXHBSA-M
SMILES
CC(\C=C\[C@]1(O)C(C)=CC(=O)CC1(C)C)=C/C([O-])=O
ChEBI Ontology
Outgoing
(
R
)-2-
trans
-abscisate (
CHEBI:62433
)
is a
2-
trans
-abscisate (
CHEBI:62429
)
(
R
)-2-
trans
-abscisate (
CHEBI:62433
)
is conjugate base of
(
R
)-2-
trans
-abscisic acid (
CHEBI:18657
)
(
R
)-2-
trans
-abscisate (
CHEBI:62433
)
is enantiomer of
(
S
)-2-
trans
-abscisate (
CHEBI:62421
)
Incoming
(
R
)-2-
trans
-abscisic acid (
CHEBI:18657
)
is conjugate acid of
(
R
)-2-
trans
-abscisate (
CHEBI:62433
)
(
S
)-2-
trans
-abscisate (
CHEBI:62421
)
is enantiomer of
(
R
)-2-
trans
-abscisate (
CHEBI:62433
)
IUPAC Name
(2
E
,4
E
)-
5-
[(1
R
)-
1-
hydroxy-
2,6,6-
trimethyl-
4-
oxocyclohex-
2-
en-
1-
yl]-
3-
methylpenta-
2,4-
dienoate
Last Modified
24 June 2011