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(1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol

(1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol structure

CAS No:
130195-35-6
Formula:
C28H27N5O6
Chemical Name:
(1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol
Synonyms:
130195-35-6;Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenz(a)anthracen-1-yl)-, (1S-(1alpha,2alpha,3alpha,4beta))-;DTXSID40156398

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(1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol Basic Attributes

Molecular Weight：

529.5 g/mol

Exact Mass：

529.19613360 g/mol

DSSTox ID：

DTXSID40156398

Characteristics

PSA：

166 Å²

XLogP3：

1.7684

Computed Properties

Molecular Weight:529.5
XLogP3:1.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:4
Exact Mass:529.19613360
Monoisotopic Mass:529.19613360
Topological Polar Surface Area:166
Heavy Atom Count:39
Complexity:872
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: ethoxide; diphenylamine; phosphorus trichloride; chronic gastritis; cholinoid; ambeed

Guide of (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol

Basic Attributes
Characteristics
Computed Properties

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