(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid
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![(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b7cf41faff5b483e9896338ad8bd5589.png "(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid")
(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid
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CAS No:
95674-54-7
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Formula:
C21H26N6O5
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Chemical Name:
(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid
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Synonyms:
5,10-DDTAP;5,10-dideaza-5,6,7,8-tetrahydroaminopterin;95674-54-7;5,10-Ddtap;SCHEMBL9536119;DTXSID20914872;(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid;5,10-Dideaza-5,6,7,8-tetrahydroaminopterin;L-Glutamic acid, N-(4-(2-(2,4-diamino-1,5,6,7-tetrahydropyrido(2,3-d)pyrimidin-6-yl)ethyl)benzoyl)-;N-{4-[2-(4-Amino-2-imino-1,2,3,5,6,7-hexahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl}glutamic acid
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CAS No:
(2S)-2-[[4-[2-(2,4-diamino-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoyl]amino]pentanedioic acid Basic Attributes
442.5 g/mol
442.19646795 g/mol
Computed Properties
Molecular Weight:442.5
XLogP3:1.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:442.19646795
Monoisotopic Mass:442.19646795
Topological Polar Surface Area:194
Heavy Atom Count:32
Complexity:671
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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