adenylyl molybdenum cofactor

Chemical Formula:

C₂₀H₂₂N₁₀O₁₄P₂S₂MO

Molecular Weight:

848.46 Daltons

Monoisotopic Mass:

851.9444177318 Daltons

SMILES:

C(OP(=O)([O-])OP(=O)([O-])OCC3(OC1(NC4(N=C(N)NC(=O)C(NC1C2(=C(S[Mo](=O)(=O)S2)3))=4))))C5(OC(C(O)C(O)5)N7(C=NC6(C(N)=NC=NC=67)))

InChI:

1S/C20H26N10O12P2S2.Mo.2O/c21-14-8-16(24-3-23-14)30(4-25-8)19-11(32)10(31)5(41-19)1-38-43(34,35)42-44(36,37)39-2-6-12(45)13(46)7-18(40-6)27-15-9(26-7)17(33)29-20(22)28-15;;;/h3-7,10-11,18-19,26,31-32,45-46H,1-2H2,(H,34,35)(H,36,37)(H2,21,23,24)(H4,22,27,28,29,33);;;/q;+2;;/p-4/t5-,6?,7?,10-,11-,18?,19-;;;/m1.../s1

InChIKey:

MTRSUXWOAAHQLJ-GOOAGKMJSA-J

Synonyms

MAD
MPT-AMP
bis-molybdopterin adenine dinucleotide
MoO₂(OH)Dtpp-mADP
molybdopterin adenine dinucleotide

Databases

MetaCyc: CPD-13035

PubChem (CID): 50986114 136093638

MetaNetX: MNXM62329