5-methyl-5,6,7,8-tetrahydromethanopterin

Molecular Formula: C₃₁H₄₇N₆O₁₆P

InChI: InChI=1/C31H47N6O16P/c1-13(22-14(2)34-27-23(37(22)3)28(45)36-31(32)35-27)33-16-6-4-15(5-7-16)10-17(38)24(42)18(39)11-50-30-26(44)25(43)20(52-30)12-51-54(48,49)53-19(29(46)47)8-9-21(40)41/h4-7,13-14,17-20,22,24-26,30,33,38-39,42-44H,8-12H2,1-3H3,(H,40,41)(H,46,47)(H,48,49)(H4,32,34,35,36,45)/t13-,14+,17+,18-,19+,20-,22+,24+,25-,26-,30+/m1/s1/f/h34-35,40,46,48H,32H2

InChIKey: InChIKey=SWBKYDXMQNCIAW-BLNOTKGYDA
SMILES: CC1C(N(C2=C(N1)NC(=NC2=O)N)C)C(C)NC3=CC=C(C=C3)CC(C(C(COC4C(C(C(O4)COP(=O)(O)OC(CCC(=O)O)C(=O)O)O)O)O)O)O

Names:
    C04488
    (2S)-2-[[(2R,3S,4R,5S)-5-[(2R,3S,4S)-5-[4-[[(1R)-1-[(6S,7S)-2-amino-5,7-dimethyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]ethyl]amino]phenyl]-2,3,4-trihydroxy-pentoxy]-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxypentanedioic acid
    5-Methyltetrahydromethanopterin
    5-methyl-H4MPT
    5-methyl-5,6,7,8-tetrahydromethanopterin
    92481-97-5

Registries:
    PubChem CID 5462263
    PubChem ID 7107