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677297-51-7 molecular structure
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3-[2,4-diamino-7-(3-hydroxyphenyl)pteridin-6-yl]phenol

ChemBase ID: 72631
Molecular Formular: C18H14N6O2
Molecular Mass: 346.34276
Monoisotopic Mass: 346.11782372
SMILES and InChIs

SMILES:
c1(c(nc2c(n1)c(nc(n2)N)N)c1cccc(c1)O)c1cc(ccc1)O
Canonical SMILES:
Oc1cccc(c1)c1nc2nc(N)nc(c2nc1c1cccc(c1)O)N
InChI:
InChI=1S/C18H14N6O2/c19-16-15-17(24-18(20)23-16)22-14(10-4-2-6-12(26)8-10)13(21-15)9-3-1-5-11(25)7-9/h1-8,25-26H,(H4,19,20,22,23,24)
InChIKey:
UJIAQDJKSXQLIT-UHFFFAOYSA-N

Cite this record

CBID:72631 http://www.chembase.cn/molecule-72631.html

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