IBD Research Resource Center

BioID	bio183765
Name	DDA-TRIPHOSPHATE
ChEMBL ID	CHEMBL1383
Molecular Formula	C10H16N5O11P3
Molecular Weight	475.18
Molecular Weight (Monoisotopic)	475.0059
Type	Small molecule
Max Phase	Unknown
Target ID	Tar57
Target Name	None
Synonyms	2',3'-DDATP\|2',3'-DIDEOXY-ATP\|DDATP\|ddA-TRIPHOSPHATE
Smiles	Nc1ncnc2c1ncn2[C@H]1CC[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1
Inchi	InChI=1S/C10H16N5O11P3/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(24-7)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h4-7H,1-3H2,(H,19,20)(H,21,22)(H2,11,12,13)(H2,16,17,18)/t6-,7+/m0/s1
Inchi Key	OAKPWEUQDVLTCN-NKWVEPMBSA-N
Molecular Species	ACID
Targets	3.0
Bioactivities	28.0
Np Likeness Score	1.11
Records Key	['ddATP', 'ddATP', 'ddATP', 'ddA-TP', 'ddATP', 'ddATP', 'ddTTP', 'ddATP', 'DDA-TRIPHOSPHATE']
Records Name	['[[[5-(6-amino-9H-purin-9-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxyphosphonic acid', '6-amino-9-(5-{[(1,2,3,3-tetrahydroxy-1,2,3-trioxidotriphosphanyl)oxy]methyl}tetrahydrofuran-2-yl)-9H-purine', 'ddATP', 'ddA-TP', '((2S,5R)-5-(6-amino-9H-purin-9-yl)tetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate', 3',5'-dideoxy ATP", '((2S,5R)-5-(6-amino-9H-purin-9-yl)tetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate', "2',3'-dideoxyadenosine-5'-triphosphate", 'DDA-TRIPHOSPHATE']"
Withdrawn Flag	False
Orphan	0