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> Main
CHEBI:139183 - 5,6-epoxyretinoate
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ChEBI Name
5,6-epoxyretinoate
ChEBI ID
CHEBI:139183
Definition
A monocarboxylic acid anion that is the conjugate base of 5,6-epoxyretinoic acid arising from deprotonation of the carboxylic acid function; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
Supplier Information
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Formula
C20H27O3
Net Charge
-1
Average Mass
315.427
Monoisotopic Mass
315.19657
InChI
InChI=1S/C20H28O3/c1-
15(8-
6-
9-
16(2)
14-
17(21)
22)
10-
13-
20-
18(3,4)
11-
7-
12-
19(20,5)
23-
20/h6,8-
10,13-
14H,7,11-
12H2,1-
5H3,(H,21,22)
/p-
1/b9-
6+,13-
10+,15-
8+,16-
14+
InChIKey
KEEHJLBAOLGBJZ-WEDZBJJJSA-M
SMILES
C12(C(CCCC1(C)O2)(C)C)/C=C/C(=C/C=C/C(=C/C([O-])=O)/C)/C
ChEBI Ontology
Outgoing
5,6-epoxyretinoate (
CHEBI:139183
)
is a
monocarboxylic acid anion (
CHEBI:35757
)
5,6-epoxyretinoate (
CHEBI:139183
)
is a
retinoid anion (
CHEBI:139589
)
5,6-epoxyretinoate (
CHEBI:139183
)
is conjugate base of
5,6-epoxyretinoic acid (
CHEBI:80658
)
Incoming
5,6-epoxyretinoic acid (
CHEBI:80658
)
is conjugate acid of
5,6-epoxyretinoate (
CHEBI:139183
)
IUPAC Name
(2
E
,4
E
,6
E
,8
E
)-
3,7-
dimethyl-
9-
(2,2,6-
trimethyl-
7-
oxabicyclo[4.1.0]heptan-
1-
yl)nona-
2,4,6,8-
tetraenoate
Synonyms
Sources
all-
trans
-5,6-epoxyretinoate
UniProt
all
-
trans
-5,6-epoxyretinoate
ChEBI
Citations
Types
Sources
10702251
PubMed citation
SUBMITTER
7056740
PubMed citation
SUBMITTER
Last Modified
06 February 2018