thio-molybdenum cofactor

Chemical Formula:

C₁₀H₁₀N₅O₇PS₃MO

Molecular Weight:

535.312 Daltons

Monoisotopic Mass:

538.8690541459 Daltons

SMILES:

C(OP([O-])(=O)[O-])C2(C1(S[Mo](=S)(=O)SC=1[CH]3([CH](O2)NC4(=C(N3)C(=O)NC(N)=N4))))

InChI:

1S/C10H14N5O6PS2.Mo.O.S/c11-10-14-7-4(8(16)15-10)12-3-6(24)5(23)2(21-9(3)13-7)1-20-22(17,18)19;;;/h2-3,9,12,23-24H,1H2,(H2,17,18,19)(H4,11,13,14,15,16);;;/q;+2;;/p-4/t2-,3+,9-;;;/m1.../s1

InChIKey:

QNGJROMMAHOOFQ-JSUDGWJLSA-J

Synonyms

moco (sulfide)
MoOS(OH)Dtpp-mP
molybdenum cofactor (sulfide)

Databases

MetaCyc: CPD-8124

ChEBI: 82685

PubChem (CID): 86289927 135926548

HMDB: HMDB59640

MetaNetX: MNXM93955

KEGG: C21486