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ChEBI
> Main
CHEBI:34970 - saxitoxin
Main
ChEBI Ontology
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ChEBI Name
saxitoxin
ChEBI ID
CHEBI:34970
Definition
An alkaloid isolated from the marine dinoflagellates and cyanobacteria that causes paralytic shellfish poisoning.
Stars
This entity has been manually annotated by the ChEBI Team.
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Wikipedia
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Read full article at Wikipedia
Formula
C10H17N7O4
Net Charge
0
Average Mass
299.28650
Monoisotopic Mass
299.13420
InChI
InChI=1S/C10H17N7O4/c11-
6-
15-
5-
4(3-
21-
8(13)
18)
14-
7(12)
17-
2-
1-
9(19,20)
10(5,17)
16-
6/h4-
5,19-
20H,1-
3H2,(H2,12,14)
(H2,13,18)
(H3,11,15,16)
/t4-
,5-
,10-
/m0/s1
InChIKey
RPQXVSUAYFXFJA-HGRQIUPRSA-N
SMILES
NC(=O)OC[C@@H]1NC(=N)N2CCC(O)(O)[C@@]22NC(=N)N[C@@H]12
Roles Classification
Biological Role
(s):
sodium channel blocker
An agent that inhibits sodium influx through cell membranes.
(via
paralytic shellfish toxin
)
marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
(via
paralytic shellfish toxin
)
cyanotoxin
Any toxin produced by cyanobacteria (blue-green algae).
toxin
Poisonous substance produced by a biological organism such as a microbe, animal or plant.
(via
paralytic shellfish toxin
)
neurotoxin
A poison that interferes with the functions of the nervous system.
(via
paralytic shellfish toxin
)
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
saxitoxin (
CHEBI:34970
)
has role
cyanotoxin (
CHEBI:88048
)
saxitoxin (
CHEBI:34970
)
has role
marine metabolite (
CHEBI:76507
)
saxitoxin (
CHEBI:34970
)
has role
neurotoxin (
CHEBI:50910
)
saxitoxin (
CHEBI:34970
)
has role
sodium channel blocker (
CHEBI:38633
)
saxitoxin (
CHEBI:34970
)
has role
toxin (
CHEBI:27026
)
saxitoxin (
CHEBI:34970
)
is a
alkaloid (
CHEBI:22315
)
saxitoxin (
CHEBI:34970
)
is a
carbamate ester (
CHEBI:23003
)
saxitoxin (
CHEBI:34970
)
is a
guanidines (
CHEBI:24436
)
saxitoxin (
CHEBI:34970
)
is a
ketone hydrate (
CHEBI:63734
)
saxitoxin (
CHEBI:34970
)
is a
paralytic shellfish toxin (
CHEBI:167564
)
saxitoxin (
CHEBI:34970
)
is a
pyrrolopurine (
CHEBI:136861
)
saxitoxin (
CHEBI:34970
)
is conjugate base of
saxitoxin(2+) (
CHEBI:180458
)
Incoming
neosaxitoxin (
CHEBI:167561
)
has functional parent
saxitoxin (
CHEBI:34970
)
saxitoxin acetate (
CHEBI:142400
)
has part
saxitoxin (
CHEBI:34970
)
saxitoxin(2+) (
CHEBI:180458
)
is conjugate acid of
saxitoxin (
CHEBI:34970
)
IUPAC Name
[(3a
S
,4
R
,10a
S
)-
10,10-
dihydroxy-
2,6-
diiminooctahydro-
1
H
,8
H
-
pyrrolo[1,2-
c
]purin-
4-
yl]methyl carbamate
Manual Xrefs
Databases
34106
ChemSpider
C00051761
KNApSAcK
C13757
KEGG COMPOUND
FDB000437
FooDB
HMDB0029368
HMDB
Saxitoxin
Wikipedia
View more database links
Registry Numbers
Types
Sources
35523-89-8
CAS Registry Number
ChemIDplus
47858
Reaxys Registry Number
Reaxys
Citations
Types
Sources
22628533
PubMed citation
Europe PMC
23966031
PubMed citation
Europe PMC
24184516
PubMed citation
Europe PMC
24460188
PubMed citation
Europe PMC
32323358
PubMed citation
Europe PMC
32485372
PubMed citation
Europe PMC
33086288
PubMed citation
Europe PMC
33104353
PubMed citation
Europe PMC
33113659
PubMed citation
Europe PMC
33526182
PubMed citation
Europe PMC
33748075
PubMed citation
Europe PMC
33813339
PubMed citation
Europe PMC
Last Modified
20 April 2021