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7-(2-Deoxy-5-Ophosphono-β-D-erythro-pentofuranosyl)-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-4-amine

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Catalog No. : NC18275

CAS No. : 1190922-14-5

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₁H₁₄IN₄O₆P

Chemical Name : 7-(2-Deoxy-5-Ophosphono-β-D-erythro-pentofuranosyl)-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Molecular Weight : 456.13

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Basic information

Standard English name
Cas No.	1190922-14-5
Alias	((2R,3S,5R)-5-(4-amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-3-hydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate
Canonical Smiles	NC1N=CN=C2C=1C(I)=CN2[C@H]1C[C@H](O)[C@@H](COP(O)(O)=O)O1
MDL No.
Exact Mass	455.96956
Smiles	NC1=C2C(N([C@H]3C[C@@H]([C@@H](COP(O)(O)=O)O3)O)C=C2I)=NC=N1

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Inchi	InChI=1S/C11H14IN4O6P/c12-5-2-16(11-9(5)10(13)14-4-15-11)8-1-6(17)7(22-8)3-21-23(18,19)20/h2,4,6-8,17H,1,3H2,(H2,13,14,15)(H2,18,19,20)/t6-,7+,8+/m0/s1
InchiKey	KYIMZOMRQYYCON-XLPZGREQSA-N
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