dATP

Chemical Formula:

C₁₀H₁₂N₅O₁₂P₃

Molecular Weight:

487.152 Daltons

Monoisotopic Mass:

491.0008305348 Daltons

SMILES:

C(C3(C(CC(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O))OP(OP(OP([O-])(=O)[O-])([O-])=O)([O-])=O

InChI:

1S/C10H16N5O12P3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(25-7)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H,22,23)(H2,11,12,13)(H2,17,18,19)/p-4/t5-,6+,7+/m0/s1

InChIKey:

SUYVUBYJARFZHO-RRKCRQDMSA-J

Synonyms

2'-deoxyATP
2'-deoxyadenosine triphosphate
deoxy-ATP
deoxyadenosine-triphosphate
2'-deoxyadenosine-5'-triphosphate

Databases

MetaCyc: DATP

RefMet: dATP

BiGG: datp

MetaboLights: MTBLC61404

HMDB: HMDB01532

ChEBI: 61404 16284

PubChem (CID): 25320183 15993

KEGG: C00131

CAS: 1927-31-7

NIKKAJI: J90.479A

3DMET: B01169

PDB-CCD: DTP

CHEMBL: CHEMBL335538

PupChem (SID): 3431

Reactome: 110644

Seed: cpd00115

MetaNetX: MNXM286