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(Q76285996)
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English
(2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
hemiterpenoid
0 references
mass
262.000740604
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅H₁₂O₈P₂
0 references
canonical SMILES
O=P(O)(O)OP(=O)(O)OCC=C(C)CO
0 references
isomeric SMILES
C/C(=C\COP(=O)(O)OP(=O)(O)O)/CO
0 references
found in taxon
Escherichia coli
1 reference
stated in
A comprehensive genome-scale reconstruction of Escherichia coli metabolism--2011.
subject has role
primary metabolite
1 reference
stated in
Reactome
reference URL
https://plantreactome.gramene.org/PathwayBrowser/#/R-OSA-2744345&DTAB=MT
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)/b5-2+
0 references
InChIKey
MDSIZRKJVDMQOQ-GORDUTHDSA-N
0 references
PubChem CID
5281976
0 references
ChEBI ID
15664
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
UniChem compound ID
229172
1 reference
stated in
UniChem
LIPID MAPS ID
LMPR01010009
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
IEDB Epitope ID
194672
1 reference
stated in
Immune Epitope Database and Analysis Resource
IEDB Epitope ID
194672
retrieved
19 May 2022
PDB ligand ID
H6P
0 references
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