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ChEBI
> Main
CHEBI:139714 - ascr#9(1−)
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ChEBI Name
ascr#9(1−)
ChEBI ID
CHEBI:139714
ChEBI ASCII Name
ascr#9(1-)
Definition
A monocarboxylic acid anion that is conjugate base of ascr#9 resulting from the deprotonation of the carboxy group; Major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Michael Witting
Supplier Information
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Molfile
Formula
C11H19O6
Net Charge
-1
Average Mass
247.268
Monoisotopic Mass
247.11871
InChI
InChI=1S/C11H20O6/c1-
6(3-
4-
10(14)
15)
16-
11-
9(13)
5-
8(12)
7(2)
17-
11/h6-
9,11-
13H,3-
5H2,1-
2H3,(H,14,15)
/p-
1/t6-
,7+,8-
,9-
,11-
/m1/s1
InChIKey
NZMXMOQNHSVRAJ-WNPHYYBUSA-M
SMILES
C[C@H](CCC([O-])=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing
ascr#9(1−) (
CHEBI:139714
)
is a
monocarboxylic acid anion (
CHEBI:35757
)
ascr#9(1−) (
CHEBI:139714
)
is conjugate base of
ascr#9 (
CHEBI:79018
)
Incoming
icas#9(1−) (
CHEBI:140804
)
has functional parent
ascr#9(1−) (
CHEBI:139714
)
ascr#9 (
CHEBI:79018
)
is conjugate acid of
ascr#9(1−) (
CHEBI:139714
)
IUPAC Name
(4
R
)-4-[(3,6-dideoxy-α-
L
-
arabino
-hexopyranosyl)oxy]pentanoate
Synonyms
Sources
asc-C5 anion
ChEBI
asc-C5(1−)
ChEBI
ascr#9 anion
ChEBI
Last Modified
24 January 2024