(2S)-2-[[4-[[(2,4-diaminopteridin-6-yl)methylamino]methyl]benzoyl]amino]pentanedioic acid
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![(2S)-2-[[4-[[(2,4-diaminopteridin-6-yl)methylamino]methyl]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/440d7a3a5aaa42edb50c19beb70948d0.png "(2S)-2-[[4-[[(2,4-diaminopteridin-6-yl)methylamino]methyl]benzoyl]amino]pentanedioic acid")
(2S)-2-[[4-[[(2,4-diaminopteridin-6-yl)methylamino]methyl]benzoyl]amino]pentanedioic acid
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CAS No:
39271-61-9
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Formula:
C20H22N8O5
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Chemical Name:
(2S)-2-[[4-[[(2,4-diaminopteridin-6-yl)methylamino]methyl]benzoyl]amino]pentanedioic acid
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Synonyms:
isohomoaminopterin;Isohomoaminopterin;39271-61-9;DTXSID10960020;N-(4-((((2,4-Diamino-6-pteridinyl)methyl)amino)methyl)benzoyl)-L-glutamic acid;N-[4-({[(4-Amino-2-imino-2,3-dihydropteridin-6-yl)methyl]amino}methyl)benzoyl]glutamic acid
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CAS No:
(2S)-2-[[4-[[(2,4-diaminopteridin-6-yl)methylamino]methyl]benzoyl]amino]pentanedioic acid Basic Attributes
454.4 g/mol
454.17131583 g/mol
Computed Properties
Molecular Weight:454.4
XLogP3:-4.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:454.17131583
Monoisotopic Mass:454.17131583
Topological Polar Surface Area:219
Heavy Atom Count:33
Complexity:689
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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