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(Q82977594)
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English
7,8-dihydro-D-neopterin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pteridine
0 references
mass
255.096753896
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₃N₅O₄
0 references
canonical SMILES
N=C1N=C(O)C=2N=C(CNC2N1)C(O)C(O)CO
0 references
found in taxon
Escherichia coli
1 reference
stated in
A comprehensive genome-scale reconstruction of Escherichia coli metabolism--2011.
Identifiers
InChI
InChI=1S/C9H13N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h4,6,15-17H,1-2H2,(H4,10,11,13,14,18)
0 references
InChIKey
YQIFAMYNGGOTFB-UHFFFAOYSA-N
0 references
CAS Registry Number
6917-20-0
0 references
PubChem CID
135402024
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
YQIFAMYNGGOTFB-UHFFFAOYSA-N
UniChem compound ID
32005096
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60988875
1 reference
matched by identifier from
InChIKey
InChIKey
YQIFAMYNGGOTFB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30912400
0 references
Cannabis Database ID
005167
1 reference
stated in
Cannabis Database
Human Metabolome Database ID
HMDB0244465
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQIFAMYNGGOTFB-UHFFFAOYSA-N
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