biotinyl-5'-adenylate

Chemical Formula:

C₂₀H₂₇N₇O₉PS

Molecular Weight:

572.509 Daltons

Monoisotopic Mass:

573.1406827341 Daltons

SMILES:

C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP([O-])(=O)OC(=O)CCCCC4(SC[CH]5(NC(=O)N[CH]45))

InChI:

1S/C20H28N7O9PS/c21-17-14-18(23-7-22-17)27(8-24-14)19-16(30)15(29)10(35-19)5-34-37(32,33)36-12(28)4-2-1-3-11-13-9(6-38-11)25-20(31)26-13/h7-11,13,15-16,19,29-30H,1-6H2,(H,32,33)(H2,21,22,23)(H2,25,26,31)/p-1/t9-,10+,11-,13-,15+,16+,19+/m0/s1

InChIKey:

UTQCSTJVMLODHM-RHCAYAJFSA-M

Synonyms

biotinyl-5'-AMP

Databases

MetaCyc: BIO-5-AMP

PubChem (CID): 53239798

HMDB: HMDB04220

ChEBI: 62414

KEGG: C05921

MetaNetX: MNXM2351