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5′-Deoxyadenosine

5′-Deoxyadenosine structure

CAS No:
4754-39-6
Formula:
C10H13N5O3
Chemical Name:
5′-Deoxyadenosine
Synonyms:
Adenosine,5′-deoxy-;5′-Deoxyadenosine;14357-30-3
Categories:
Biochemical Engineering > Saccharides

Description

5'-Deoxyadenosine is an oxidized nucleoside found in the urine of normal subjects.

Solid

5'-deoxyadenosine is a 5'-deoxyribonucleoside compound having adenosine as the nucleobase. It has a role as a human metabolite, an Escherichia coli metabolite and a mouse metabolite. It is a 5'-deoxyribonucleoside and a member of adenosines. It derives from an adenosine.

5′-Deoxyadenosine Basic Attributes

Molecular Weight：

251.246

Exact Mass：

251.24

UNII：

2U0TYC8Y5A

Characteristics

PSA：

119

XLogP3：

-0.6

Appearance：

Solid

Density：

1.93g/cm3

Melting Point：

205-207 °C

Boiling Point：

595ºC at 760 mmHg

Flash Point：

313.6ºC

Refractive Index：

1.867

Collision Cross Section：

166.8 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|151.91 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|162.1 Å² [M+H]+ [CCS Type: DT, Method: stepped-field]|171.99 Å² [M+Na]+ [CCS Type: DT, Method: stepped-field]|160.19 Å² [M-H]- [CCS Type: DT, Method: stepped-field]|152.3 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|158.4 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|167.2 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|154.8 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|154.9 Å² [M-H]-

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

RTECS Number：

AU7358650

Drug Information

MeSH Entry Terms：

5'-dAdo nucleoside

Computed Properties

Molecular Weight:251.24
XLogP3:-0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:251.10183929
Monoisotopic Mass:251.10183929
Topological Polar Surface Area:119
Heavy Atom Count:18
Complexity:320
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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5'-DEOXYADENOSINE

CAS No.: 4754-39-6

Grade: Industrial Grade

Content: 99.0%

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Guide of 5′-Deoxyadenosine

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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5′-Deoxyadenosine

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