3'-keto-3'-dehydroATP

Chemical Formula:

C₁₀H₁₀N₅O₁₃P₃

Molecular Weight:

501.136 Daltons

Monoisotopic Mass:

504.98009509269997 Daltons

SMILES:

C(OP(OP(OP([O-])(=O)[O-])(=O)[O-])(=O)[O-])C1(C(=O)C(O)C(O1)N2(C3(=C(N=C2)C(N)=NC=N3)))

InChI:

1S/C10H14N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,7,10,17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/p-4/t4-,7-,10?/m1/s1

InChIKey:

DWVQEFBZTUVQKH-QKPIFBDGSA-J

Synonyms

3'-keto-3'-deoxyATP
3'-keto-3'-deoxy-ATP

Databases

MetaCyc: CPD-10076

ChEBI: 27782

PubChem (CID): 46173507

KEGG: C07024

MetaNetX: MNXM164185