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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:79030 -
S
-adenosyl-3-thiopropylamine
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ChEBI Name
S
-adenosyl-3-thiopropylamine
ChEBI ID
CHEBI:79030
ChEBI ASCII Name
S-adenosyl-3-thiopropylamine
Definition
A thioadenosine that is adenosine in which the hydroxy group at C-5' is replaced by a 3-aminopropyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H20N6O3S
Net Charge
0
Average Mass
340.40100
Monoisotopic Mass
340.13176
InChI
InChI=1S/C13H20N6O3S/c14-
2-
1-
3-
23-
4-
7-
9(20)
10(21)
13(22-
7)
19-
6-
18-
8-
11(15)
16-
5-
17-
12(8)
19/h5-
7,9-
10,13,20-
21H,1-
4,14H2,(H2,15,16,17)
/t7-
,9-
,10-
,13-
/m1/s1
InChIKey
FUSRAALGPJJIRO-QYVSTXNMSA-N
SMILES
NCCCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Metabolite of Species
Details
Ariopsis felis
(NCBI:txid75286)
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
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
S
-adenosyl-3-thiopropylamine (
CHEBI:79030
)
is a
organic sulfide (
CHEBI:16385
)
S
-adenosyl-3-thiopropylamine (
CHEBI:79030
)
is a
primary amino compound (
CHEBI:50994
)
S
-adenosyl-3-thiopropylamine (
CHEBI:79030
)
is a
thioadenosine (
CHEBI:26953
)
IUPAC Name
5'-
S
-(3-aminopropyl)-5'-thioadenosine
Manual Xref
Database
DSH
PDBeChem
View more database links
Registry Numbers
Types
Sources
53186-57-5
CAS Registry Number
ChemIDplus
577457
Reaxys Registry Number
Reaxys
Citations
Types
Sources
6621400
PubMed citation
Europe PMC
7396856
PubMed citation
Europe PMC
942371
PubMed citation
Europe PMC
Last Modified
11 November 2014