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Rel-9-[(3S)-3-(Aminocarbonyl)-3-deoxy-3-methyl-α-D-threo-pentofuranosyl]-2-chloro-9H-purin-6-amine

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Catalog No. : NC382272

CAS No. : 1187859-78-4

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₂H₁₅ClN₆O₄

Chemical Name : Rel-9-[(3S)-3-(Aminocarbonyl)-3-deoxy-3-methyl-α-D-threo-pentofuranosyl]-2-chloro-9H-purin-6-amine

Molecular Weight : 342.74

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Basic information

Standard English name
Cas No.	1187859-78-4
Alias	rel-9-[(3S)-3-(Aminocarbonyl)-3-deoxy-3-methyl-α-D-threo-pentofuranosyl]-2-chloro-9H-purin-6-amine
Canonical Smiles	C[C@]1([C@@H](CO)O[C@@H]([C@H]1O)N1C=NC2C1=NC(Cl)=NC=2N)C(N)=O
MDL No.
Exact Mass	342.08433
Smiles	NC1=C2N=CN([C@@H](O[C@@H]([C@]3(C(N)=O)C)CO)[C@H]3O)C2=NC(Cl)=N1

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Inchi	InChI=1S/C12H15ClN6O4/c1-12(10(15)22)4(2-20)23-9(6(12)21)19-3-16-5-7(14)17-11(13)18-8(5)19/h3-4,6,9,20-21H,2H2,1H3,(H2,15,22)(H2,14,17,18)/t4-,6-,9+,12-/m1/s1
InchiKey	UGKWHVAJABSLKO-OKGUHQAHSA-N
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