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(Q106030213)
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English
cThz*-P
chemical compound
hexadecanoyl dihydrogen phosphate
(2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
266.99664466999997
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₇H₁₀NO₆PS
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1=NC(C(=O)O)SC1=CCOP(=O)(O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC1=N[C@@H](C(=O)O)S/C1=C\COP(=O)(O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C7H10NO6PS/c1-4-5(2-3-14-15(11,12)13)16-6(8-4)7(9)10/h2,6H,3H2,1H3,(H,9,10)(H2,11,12,13)/b5-2-/t6-/m1/s1
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
PQMCQNOVNFNPFJ-HYIMLASBSA-N
1 reference
stated in
ChEBI release 2021-03-01
PubChem CID
53477655
1 reference
stated in
ChEBI release 2021-03-01
ChEBI ID
138844
reason for deprecated rank
deprecated identifier value
0 references
134196
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
UniChem compound ID
42193192
1 reference
stated in
UniChem
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