Deoxyinosine
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Deoxyinosine
structure -
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CAS No:
890-38-0
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Formula:
C10H12N4O4
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Chemical Name:
Deoxyinosine
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Synonyms:
Inosine,2′-deoxy-;2′-Deoxyinosine;Hypoxanthine,9-(2-deoxy-β-D-erythro-pentofuranosyl)-;Deoxyinosine;9-(2-Deoxy-β-D-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one;6H-Purin-6-one,9-(2-deoxy-β-D-erythro-pentofuranosyl)-1,9-dihydro-;Hypoxanthine deoxyriboside;1049662-95-4
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CAS No:
Description
2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency.
Solid
2'-deoxyinosine is a purine 2'-deoxyribonucleoside that is inosine in which the hydroxy group at position 2' is replaced by a hydrogen. It has a role as a Saccharomyces cerevisiae metabolite, a human metabolite, a plant metabolite, an Escherichia coli metabolite and a mouse metabolite. It is a purines 2'-deoxy-D-ribonucleoside and a purine 2'-deoxyribonucleoside. It derives from an inosine.
Characteristics
109
-1.7
White to Off-white Powder
1.9±0.1 g/cm3
>250 °C (decomp)
681.2°C at 760 mmHg
329.1±34.3 °C
1.837
8.33g/L(25.02 ºC)
−20°C
21 º (c=1, H2O 22 ºC)
151.7 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|153.4 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]
Safety Information
NONH for all modes of transport
3
20/21/22-36/37/38
24/25-37/39-36-26
Xn,Xi
Stable under normal temperatures and pressures.
Deoxyinosine Use and Manufacturing
An Inosine (I661000) analog with hypotensive activity. An impurity of the antiviral drug 2’,3’-Dideoxyinosine (D440950).
Computed Properties
Molecular Weight:252.23
XLogP3:-1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:252.08585488
Monoisotopic Mass:252.08585488
Topological Polar Surface Area:109
Heavy Atom Count:18
Complexity:377
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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