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Adenosine 5'-(trihydrogen diphosphate), P'→5-ester with β-D-ribofuranose 2-acetate

Catalog No. : NC20435

CAS No. : 642090-67-3

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₇H₂₅N₅O₁₅P₂

Chemical Name : Adenosine 5'-(trihydrogen diphosphate), P'→5-ester with β-D-ribofuranose 2-acetate

Molecular Weight : 601.35

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Basic information

Standard English name
Cas No.	642090-67-3
Alias	(2R,3R,4R,5R)-5-((((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)methyl)-2,4-dihydroxytetrahydrofuran-3-yl acetate
Canonical Smiles	CC(=O)O[C@@H]1[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)O[C@H]1O
MDL No.
Exact Mass	601.08224
Smiles	CC(O[C@@H]1[C@H](O)[C@@H](COP(O)(OP(O)(OC[C@@H]2[C@@H](O)[C@@H](O)[C@H](N3C=NC4=C(N)N=CN=C43)O2)=O)=O)O[C@H]1O)=O

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Inchi	InChI=1S/C17H25N5O15P2/c1-6(23)34-13-11(25)8(36-17(13)27)3-33-39(30,31)37-38(28,29)32-2-7-10(24)12(26)16(35-7)22-5-21-9-14(18)19-4-20-15(9)22/h4-5,7-8,10-13,16-17,24-27H,2-3H2,1H3,(H,28,29)(H,30,31)(H2,18,19,20)/t7-,8-,10-,11-,12-,13-,16-,17-/m1/s1
InchiKey	BFNOPXRXIQJDHO-QJWJOKBXSA-N
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