2-[[5-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]pyrimidine-2-carbonyl]amino]pentanedioic acid
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2-[[5-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]pyrimidine-2-carbonyl]amino]pentanedioic acid
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CAS No:
54246-73-0
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Formula:
C17H17N9O6
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Chemical Name:
2-[[5-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]pyrimidine-2-carbonyl]amino]pentanedioic acid
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Synonyms:
2',6'-Diazafolsaeure; L-Glutamic acid,4-dihydro-4-oxo-6-pteridinyl)methyl]amino]-2-pyrimidinyl]carbonyl]-,monohydrate; N-{5-[(2-amino-4-oxo-3,4-dihydro-pteridin-6-ylmethyl)-amino]-pyrimidine-2-carbonyl}-glutamic acid;
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CAS No:
2-[[5-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]pyrimidine-2-carbonyl]amino]pentanedioic acid Basic Attributes
443.37400
443.13017930
173964
DTXSID60329966
Computed Properties
Molecular Weight:443.4
XLogP3:-2.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:443.13017930
Monoisotopic Mass:443.13017930
Topological Polar Surface Area:235
Heavy Atom Count:32
Complexity:770
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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