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CAS No.: | 4338-47-0 |
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Name: | KINETIN RIBOSIDE |
Article Data: | 18 |
Molecular Structure: | |
Formula: | C15H17N5O5 |
Molecular Weight: | 347.33 |
Synonyms: | Adenosine,N-furfuryl- (6CI,7CI,8CI);6-Furfuryladenosine;Furfuryladenosine;Kinetinriboside;N6-(2-Furanylmethyl)adenosine;N6-Furfuryladenosine;NSC 120958;Riboside, kinetin;Ribosylkinetin; |
EINECS: | 224-389-3 |
Density: | 1.78 g/cm3 |
Melting Point: | 152-154 °C |
Boiling Point: | 683.7 °C at760mmHg |
Flash Point: | 367.3 °C |
Appearance: | white solid |
Safety: | 24/25 |
PSA: | 138.69000 |
LogP: | -0.28410 |
Conditions | Yield |
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With triethylamine In ethanol at 60℃; for 18h; Temperature; | 93% |
With triethylamine In ethanol at 60℃; for 18h; Substitution; |
Conditions | Yield |
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With recombinant E. coli purine nucleoside phosphorylase; tris hydrochloride In water pH=8; | 93% |
kinetin riboside
Conditions | Yield |
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With sodium tetrahydroborate In tetrahydrofuran for 8h; reductive cleavage; Heating; | 85% |
Conditions | Yield |
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With water |
furan-2-ylmethanamine
(2R,3R,4R,5R)-2-((benzoyloxy)methyl)-5-(6-chloro-9H-purin-9-yl)tetrahydrofuran-3,4-diyl dibenzoate
kinetin riboside
Conditions | Yield |
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With 2-methoxy-ethanol Erwaermen des Reaktionsprodukts mit methanol.Natriummethylat; |
Conditions | Yield |
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With hydrogenchloride; sodium cyanoborohydride In methanol; water at 37℃; for 28h; pH 4.4; |
Conditions | Yield |
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Multi-step reaction with 2 steps 1: 82 percent / AcOH / ethanol / 6 h / Heating 2: 85 percent / NaBH4 / tetrahydrofuran / 8 h / Heating View Scheme |
Conditions | Yield |
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Multi-step reaction with 2 steps 1: 82 percent / AcOH / ethanol / 6 h / Heating 2: 85 percent / NaBH4 / tetrahydrofuran / 8 h / Heating View Scheme | |
Multi-step reaction with 3 steps 1: pyridine / 20 - 60 °C 2: triphenylphosphine; diethylazodicarboxylate / tetrahydrofuran / 20 °C 3: methanol; ammonia / 48 h / 20 °C View Scheme | |
Multi-step reaction with 3 steps 1.1: pyridine / 20 - 60 °C 1.2: 20 °C 2.1: triphenylphosphine; diethylazodicarboxylate / tetrahydrofuran / 20 °C 3.1: methanol; ammonia / 48 h / 20 °C View Scheme |
2,3,5-tri-O-acetyl-α-D-ribofuranosyl chloride
kinetin riboside
Conditions | Yield |
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Multi-step reaction with 2 steps 1: anschliessende Entacetylierung 2: H2O View Scheme |
Conditions | Yield |
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Multi-step reaction with 2 steps 1: xylene 2: 2-methoxy-ethanol / Erwaermen des Reaktionsprodukts mit methanol.Natriummethylat View Scheme |
The Adenosine, N-(2-furanylmethyl)-, with the CAS registry number of 4338-47-0, is also known as 6-Furfuryladenosine. It belongs to the product categories of Nucleotides and Nucleosides; Bases & Related Reagents; Nucleotides. Its EINECS registry number is 224-389-3. This chemical's molecular formula is C15H17N5O5 and molecular weight is 347.33. What's more, its systematic name is called N-(Furan-2-ylmethyl)-9-pentofuranosyl-9H-purin-6-amine. This chemical's classification codes are Agricultural Chemical; Growth regulator / Fertilizer; Mutation Data. In addition, it must be stored in airtight containers and placed in a dry place at 4 °C. Meanwhile, it should be avoided contact with light. During using it, you should avoid contacting with skin and eyes. Besides, it can be used as an anticancer and antiviral agent.
Physical properties about Adenosine, N-(2-furanylmethyl)- are: (1)ACD/LogP: -1.30; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -1.31; (4)ACD/LogD (pH 7.4): -1.3; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.6; (8)ACD/KOC (pH 7.4): 4.67; (9)#H bond acceptors: 10; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 96.9 Å2; (13)Index of Refraction: 1.798; (14)Molar Refractivity: 82.98 cm3; (15)Molar Volume: 194.4 cm3; (16)Surface Tension: 80.6 dyne/cm; (17)Density: 1.78 g/cm3; (18)Flash Point: 367.3 °C; (19)Enthalpy of Vaporization: 105.33 kJ/mol; (20)Boiling Point: 683.7 °C at 760 mmHg; (21)Vapour Pressure: 1.25E-19 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: n2c1c(ncnc1n(c2)C3OC(C(O)C3O)CO)NCc4occc4
(2) InChI: InChI=1/C15H17N5O5/c21-5-9-11(22)12(23)15(25-9)20-7-19-10-13(17-6-18-14(10)20)16-4-8-2-1-3-24-8/h1-3,6-7,9,11-12,15,21-23H,4-5H2,(H,16,17,18)
(3) InChIKey: CAGLGYNQQSIUGX-UHFFFAOYAK