2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid
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![2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/34aacd4ae96f42f28fe1c54b53ed5705.png "2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid")
2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid
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CAS No:
52777-29-4
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Formula:
C14H21N3O8
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Chemical Name:
2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid
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Synonyms:
3-(3-amino-3-carboxypropyl)-1-methylpseudouridine;ACPMPSU;Acpmpsu;3-(3-Amino-3-carboxypropyl)-1-methylpseudouridine;52777-29-4;(1s)-1-[3-(3-amino-3-carboxypropyl)-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl]-1,4-anhydro-d-ribitol;SCHEMBL1067194;DTXSID20276725;2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid;1-methyl-3-(3-amino-3-carboxypropyl)pseudouridine;1-Methyl-3-(3-carboxy-3-aminopropyl)-5-(beta-D-ribofuranosyl)pyrimidine-2,4(1H,3H)-dione;1(2H)-Pyrimidinebutanoic acid, alpha-amino-3,6-dihydro-3-methyl-2,6-dioxo-5-beta-D-ribofuranosyl-
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CAS No:
2-amino-4-[5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2,6-dioxopyrimidin-1-yl]butanoic acid Basic Attributes
359.33 g/mol
359.13286464 g/mol
DTXSID20276725
Computed Properties
Molecular Weight:359.33
XLogP3:-5.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:359.13286464
Monoisotopic Mass:359.13286464
Topological Polar Surface Area:174
Heavy Atom Count:25
Complexity:595
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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