Home > Product Catalog > Product category > Nucleotide > 5-[5-[[[4'-(Aminomethyl)-3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl]carbonyl]amino]-1-pentyn-1-yl]-2'-deoxyuridine 5'-(tetrahydrogen triphosphate)

5-[5-[[[4'-(Aminomethyl)-3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl]carbonyl]amino]-1-pentyn-1-yl]-2'-deoxyuridine 5'-(tetrahydrogen triphosphate)

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Catalog No. : NC278509

CAS No. : 1782991-40-5

Product Level :

Brand : NewCan Bio

Molecular Formula : C₃₆H₃₅N₄O₂₀P₃

Chemical Name : 5-[5-[[[4'-(Aminomethyl)-3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl]carbonyl]amino]-1-pentyn-1-yl]-2'-deoxyuridine 5'-(tetrahydrogen triphosphate)

Molecular Weight : 936.60

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Basic information

Standard English name
Cas No.	1782991-40-5
Alias	(((2R,3S,5R)-5-(5-(5-(4'-(aminomethyl)-3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-5-carboxamido)pent-1-yn-1-yl)-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl)triphosphoric acid
Canonical Smiles	NCC1C2OC3C=C(O)C=CC=3C3(OC(=O)C4C=C(C=CC3=4)C(=O)NCCCC#CC3=CN([C@H]4C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O4)C(=O)NC3=O)C=2C=CC=1O
MDL No.
Exact Mass	936.10575
Smiles	O[C@@H](C[C@H](N1C(NC(C(C#CCCCNC(C2=CC3=C(C4(C5=C(OC6=C4C=CC(O)=C6)C(CN)=C(O)C=C5)OC3=O)C=C2)=O)=C1)=O)=O)O7)[C@H]7COP(O)(OP(OP(O)(O)=O)(O)=O)=O

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Inchi	InChI=1S/C36H35N4O20P3/c37-15-22-26(42)10-9-25-31(22)57-28-13-20(41)6-8-24(28)36(25)23-7-5-18(12-21(23)34(46)58-36)32(44)38-11-3-1-2-4-19-16-40(35(47)39-33(19)45)30-14-27(43)29(56-30)17-55-62(51,52)60-63(53,54)59-61(48,49)50/h5-10,12-13,16,27,29-30,41-43H,1,3,11,14-15,17,37H2,(H,38,44)(H,51,52)(H,53,54)(H,39,45,47)(H2,48,49,50)/t27-,29+,30+,36?/m0/s1
InchiKey	NIMNXCMQXKKKCI-VGVWBRMMSA-N
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History

NC419232

1-[(5R,6S,8R,9R)-4-Amino-9-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-6-(hydroxymethyl)-2,2-dioxido-3-phenyl-7-oxa-2-thia-1-azaspiro[4.4]non-3-en-8-yl]-5-methyl-2,4(1H,3H)-pyrimidinedione