CHEBI:107271 - 6-hydroxy-5-[(6-hydroxy-1-methyl-4-oxo-2-sulfanylidene-5-pyrimidinyl)-(2-pyridinyl)methyl]-1-methyl-2-sulfanylidene-4-pyrimidinone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-hydroxy-5-[(6-hydroxy-1-methyl-4-oxo-2-sulfanylidene-5-pyrimidinyl)-(2-pyridinyl)methyl]-1-methyl-2-sulfanylidene-4-pyrimidinone
ChEBI ID CHEBI:107271
Stars This entity has been manually annotated by a third party.
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Formula C16H15N5O4S2
Net Charge 0
Average Mass 405.454
Monoisotopic Mass 405.05655
InChI InChI=1S/C16H15N5O4S2/c1-20-13(24)9(11(22)18-15(20)26)8(7-5-3-4-6-17-7)10-12(23)19-16(27)21(2)14(10)25/h3-6,8,24-25H,1-2H3,(H,18,22,26)(H,19,23,27)
InChIKey KTLIMRLDAZNZAJ-UHFFFAOYSA-N
SMILES CN1C(=C(C(=O)NC1=S)C(C2=CC=CC=N2)C3=C(N(C(=S)NC3=O)C)O)O
ChEBI Ontology
Outgoing 6-hydroxy-5-[(6-hydroxy-1-methyl-4-oxo-2-sulfanylidene-5-pyrimidinyl)-(2-pyridinyl)methyl]-1-methyl-2-sulfanylidene-4-pyrimidinone (CHEBI:107271) is a hydroxypyrimidine (CHEBI:38340)
Manual Xref Database
LSM-18625 LINCS
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