Uridine Diphosphate N-Acetylglucosamine
Grundinformationen
- CAS
528-04-1- Standard-SMILES
CC(=O)N[C@H]1[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O- InChIKey
LFTYTUAZOPRMMI-UBDZBXRQSA-N- Summenformel
- C17H27N3O17P2
- Durchschnittliche Molmasse
- 607,4 g/mol
- Monoisotopische Masse
- 607,0815704
Überblick
Uridine diphosphate-N-acetylglucosamine is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Namen und Bezeichner
- Bevorzugter Name
- Uridine Diphosphate N-Acetylglucosamine
- IUPAC
- [(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
- Englischer Name
- [[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy
- Summenformel
- C17H27N3O17P2
- Molmasse
- 607.35
Namen und Synonyme
UdpgnacUdp acetylglucosamineUridine diphosphate-N-acetylglucosamineUridine pyrophosphoacetylglucosamineAcetylglucosamine, UDPuridine diphosphate N-acetylglucosamineUridine diphospho-N-acetylglucosamineDTXSID10912327Uridine 5'-(trihydrogen diphosphate), P'-(2-(acetylamino)-2-deoxy-alpha-D-glucopyranosyl) ester((2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl) (((2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methoxy-hydroxy-phosphoryl) hydrogen phosphate[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphatePyrophosphoacetylglucosamine, Uridine
Weitere Namen anzeigen
Uridine Impurity 29Glutamic Acid Impurity 8UDP-N-acetyl-D-glucosamineUDP N-acetyl-alpha-D-glucosamineUridine 5'-(2-acetamido-2-deoxy-alpha-D-glucosyl pyrophosphate)[[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyUridinediphosphate-N-acetylglucosamineUridinediphosphate-N-acetylglucosamineUridine 5'-(trihydrogen diphosphate), P'-[2-(acetylamino)-2-deoxy-α-D-glucopyranosyl] ester
Uridine Diphospho N AcetylglucosamineDiphospho-N-Acetylglucosamine, UridineUridine Diphosphate N AcetylglucosamineDiphosphate N-Acetylglucosamine, UridineN-Acetylglucosamine, Uridine DiphosphateRefChem:933854DTXCID501341349(((((2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl)methoxy)(hydroxy)phosphoryl)oxy)((((2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy))phosphinic acid
Datenbank-Bezeichner
- CAS
528-04-1- PubChem CID
- 10705
- DTXSID
DTXSID10912327- Nikkaji
- J568.494C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -6,6
- Polarare Oberfläche (TPSA)
- 300 Ų
- H-Brücken-Donoren
- 9
- H-Brücken-Akzeptoren
- 17
- Frei drehbare Bindungen
- 10
- Schwere Atome
- 39
- Formalladung
- 0
- Komplexität
- 1.080
Experimentelle und physikochemische Eigenschaften
Collision Cross Section210.5 Ų [M+H]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Physikochemische Eigenschaften
- Dichte
- 1.86 · 1.86±0.1 g/cm3(Predicted)
- pka
- 1.1 · 1.10±0.50(Predicted)
Chemie und Industrie
Anbieter3 Anbieter
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BOC Sciences16314854226 · [email protected]
Ergänzende Hinweise
DefinitionChEBI: A UDP-amino sugar having N-acetyl-alpha-D-glucosamine as the amino sugar component.
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