7,8-dihydromethanopterin

Chemical Formula:

C₃₀H₄₀N₆O₁₆P

Molecular Weight:

771.65 Daltons

Monoisotopic Mass:

774.2473158751 Daltons

SMILES:

CC(C1(C(C)NC2(=C(N=1)C(NC(=N2)N)=O)))NC4(=CC=C(CC(C(C(COC3(C(C(C(COP([O-])(=O)OC(C([O-])=O)CCC([O-])=O)O3)O)O))O)O)O)C=C4)

InChI:

1S/C30H43N6O16P/c1-12(21-13(2)33-26-22(34-21)27(44)36-30(31)35-26)32-15-5-3-14(4-6-15)9-16(37)23(41)17(38)10-49-29-25(43)24(42)19(51-29)11-50-53(47,48)52-18(28(45)46)7-8-20(39)40/h3-6,12-13,16-19,23-25,29,32,37-38,41-43H,7-11H2,1-2H3,(H,39,40)(H,45,46)(H,47,48)(H4,31,33,35,36,44)/p-3/t12-,13+,16+,17-,18+,19-,23+,24-,25-,29+/m1/s1

InChIKey:

WTMBWYHMZCVPRJ-WJBIZLLUSA-K

Synonyms

DHMPT
dihydromethanopterin
H2MPT

Databases

MetaCyc: CPD-10789

PubChem (CID): 71296163 135911937

ChEBI: 72788

KEGG: C05927

Seed: cpd03523

MetaNetX: MNXM3586