9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione
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![9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5ca10032e72643e2a3eb401239ea3a55.png "9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione")
9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione
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CAS No:
113269-45-7
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Formula:
C10H12N4O5
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Chemical Name:
9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione
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Synonyms:
(-)-Oxetanocin X;OXT-X;113269-45-7;9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione;1H-Purine-2,6-dione, 9-(3,4-bis(hydroxymethyl)-2-oxetanyl)-3,9-dihydro-, (2R-(2a,3b,4a))-;1H-Purine-2,6-dione, 9-((2R,3R,4S)-3,4-bis(hydroxymethyl)-2-oxetanyl)-3,9-dihydro-;1H-Purine-2,6-dione, 9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)-2-oxetanyl]-3,9-dihydro-;1H-Purine-2,6-dione, 9-[3,4-bis(hydroxymethyl)-2-oxetanyl]-3,9-dihydro-, [2R-(2a,3b,4a)]-;DTXSID20150334;9-(2-Deoxy-2-hydroxymethyl-beta-D-erythro-oxetanosyl)xanthosine;9-(2-Deoxy-2-hydroxymethyl-.beta.-D-erythro-oxetanosyl)xanthosine
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CAS No:
9-[(2R,3R,4S)-3,4-bis(hydroxymethyl)oxetan-2-yl]-3H-purine-2,6-dione Basic Attributes
268.23 g/mol
268.08076950 g/mol
DTXSID20150334
Computed Properties
Molecular Weight:268.23
XLogP3:-2.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:268.08076950
Monoisotopic Mass:268.08076950
Topological Polar Surface Area:126
Heavy Atom Count:19
Complexity:405
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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