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(Q110173715)
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English
P-(4-Hydroxy-3-methyl-2-buten-1-yl) trihydrogen (diphosphate)
group of stereoisomers with the chemical formula C₅H₁₂O₈P₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
262.000740604
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅H₁₂O₈P₂
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canonical SMILES
O=P(O)(O)OP(=O)(O)OCC=C(C)CO
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found in taxon
Escherichia coli
1 reference
stated in
A comprehensive genome-scale reconstruction of Escherichia coli metabolism--2011.
Identifiers
InChI
InChI=1S/C5H12O8P2/c1-5(4-6)2-3-12-15(10,11)13-14(7,8)9/h2,6H,3-4H2,1H3,(H,10,11)(H2,7,8,9)
0 references
InChIKey
MDSIZRKJVDMQOQ-UHFFFAOYSA-N
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CAS Registry Number
773050-78-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
786
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MDSIZRKJVDMQOQ-UHFFFAOYSA-N
UniChem compound ID
58741651
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID101182096
1 reference
matched by identifier from
InChIKey
InChIKey
MDSIZRKJVDMQOQ-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0242600
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MDSIZRKJVDMQOQ-UHFFFAOYSA-N
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