5,10-methenyltetrahydromethanopterin

5,10-methenyltetrahydromethanopterin




Chemical Formula:
C31H41N6O16P
Molecular Weight:
784.669 Daltons
Monoisotopic Mass:
787.2551409072 Daltons
SMILES:
CC4([CH]3(C(C)[N+](C2(C=CC(CC(O)C(O)C(O)COC1(C(O)C(C(COP([O-])(=O)OC(C(=O)[O-])CCC(=O)[O-])O1)O))=CC=2))=CN3C5(C(=O)NC(N)=NC(N4)=5)))
InChI:
1S/C31H43N6O16P/c1-13-22-14(2)36(12-37(22)23-27(33-13)34-31(32)35-28(23)45)16-5-3-15(4-6-16)9-17(38)24(42)18(39)10-50-30-26(44)25(43)20(52-30)11-51-54(48,49)53-19(29(46)47)7-8-21(40)41/h3-6,12-14,17-20,22,24-26,30,38-39,42-44H,7-11H2,1-2H3,(H6-,32,33,34,35,40,41,45,46,47,48,49)/p-2/t13-,14+,17-,18+,19-,20+,22+,24-,25+,26+,30-/m0/s1
InChIKey:
RANKJVUGLXUXOL-CAFBYHECSA-L

Synonyms
  • methenyl-H4MPT
  • N5,N10-methenyltetrahydromethanopterin
  • 5,10-methenyl-H4MPT
  • N5,N10-methenyl-5,6,7,8-tetrahydromethanopterin
  • 5,10-methenyl-5,6,7,8-tetrahydromethanopterin
  • 5,10-methenyl-tetrahydromethanopterin

Databases
MetaCyc:  METHENYLTETRAHYDROMETHANOPTERIN
ChEBI:  58337
PubChem (CID):  49852323 135926581
KEGG:  C04330
Seed:  cpd02655
MetaNetX:  MNXM809