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(Q90539629)
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English
2,4(1H,3H)-Pyrimidinedione, 1-[5-O-[(carboxymethyl)hydroxyphosphinyl]-β-D-arabinofuranosyl]-5-methyl-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
380.098466882
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₇N₂O₁₀P
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canonical SMILES
CC1=CC(C2OC(COP(=O)(O)CC(=O)O)C(O)C2O)C(=O)NC1N
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC1=CC([C@@H]2O[C@H](COP(=O)(O)CC(=O)O)[C@@H](O)[C@@H]2O)C(=O)NC1N
1 reference
based on heuristic
inferred from InChI
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
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Identifiers
InChI
InChI=1S/C13H21N2O9P/c1-5-2-6(13(20)15-12(5)14)11-10(19)9(18)7(24-11)3-23-25(21,22)4-8(16)17/h2,6-7,9-12,18-19H,3-4,14H2,1H3,(H,15,20)(H,16,17)(H,21,22)/t6?,7-,9-,10+,11+,12?/m1/s1
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InChIKey
OOLZTQKPPIBNQH-AQNVVLNISA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
117627-14-2
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PubChem CID
3008470
1 reference
matched by identifier from
InChIKey
InChIKey
OOLZTQKPPIBNQH-AQNVVLNISA-N
DSSTox substance ID
DTXSID50922480
1 reference
matched by identifier from
InChIKey
InChIKey
OOLZTQKPPIBNQH-AQNVVLNISA-N
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