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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:6248 - (2
S
,4
S
)-hypoglycin A
Main
ChEBI Ontology
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ChEBI Name
(2
S
,4
S
)-hypoglycin A
ChEBI ID
CHEBI:6248
ChEBI ASCII Name
(2S,4S)-hypoglycin A
Definition
A 2-amino-3-(2-methylenecyclopropyl)propanoic acid that has
L
configuration at the amino-bearing carbon and
S
configuration at the methylenecylopropyl centre.
Stars
This entity has been manually annotated by a third party.
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Molfile
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Molfile
Formula
C7H11NO2
Net Charge
0
Average Mass
141.168
Monoisotopic Mass
141.07898
InChI
InChI=1S/C7H11NO2/c1-4-2-5(4)3-6(8)7(9)10/h5-6H,1-3,8H2,(H,9,10)/t5-,6-/m0/s1
InChIKey
OOJZCXFXPZGUBJ-WDSKDSINSA-N
SMILES
[C@]1(C(=C)C1)(C[C@@H](C(O)=O)N)[H]
Metabolite of Species
Details
Blighia sapida
(NCBI:txid259381)
Found in fruit
(BTO:0000486)
. See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
phytotoxin
Any toxin produced by a plant.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(2
S
,4
S
)-hypoglycin A (
CHEBI:6248
)
has role
phytotoxin (
CHEBI:38231
)
(2
S
,4
S
)-hypoglycin A (
CHEBI:6248
)
has role
plant metabolite (
CHEBI:76924
)
(2
S
,4
S
)-hypoglycin A (
CHEBI:6248
)
is a
2-amino-3-(2-methylenecyclopropyl)propanoic acid (
CHEBI:136270
)
(2
S
,4
S
)-hypoglycin A (
CHEBI:6248
)
is a
non-proteinogenic
L
-α-amino acid (
CHEBI:83822
)
Incoming
(2
S
,4
S
)-hypoglycin B (
CHEBI:6332
)
has functional parent
(2
S
,4
S
)-hypoglycin A (
CHEBI:6248
)
hypoglycin A (
CHEBI:134622
)
has part
(2
S
,4
S
)-hypoglycin A (
CHEBI:6248
)
IUPAC Name
3-[(1
S
)-2-methylenecyclopropyl]-
L
-alanine
Synonyms
Sources
(+)-hypoglycin A
ChEBI
L-Hypoglycin
KEGG COMPOUND
Manual Xrefs
Databases
C00001372
KNApSAcK
C08287
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
156-56-9
CAS Registry Number
KEGG COMPOUND
2936735
Reaxys Registry Number
Reaxys
Last Modified
28 February 2017