N5,N10-Methenyltetrahydromethanopterin

Molecular Formula: C31H44N6O16P+


InChI: InChI=1/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+1/t13-,14+,17-,18+,19-,20+,22+,24-,25+,26+,30-/m0/s1/fC31H44N6O16P/h33-34,40,46,48H,32H2/q+1

InChIKey: InChIKey=RANKJVUGLXUXOL-SUVKWFFVDQ
SMILES: CC1C2C(N(C=[N+]2C3=C(N1)NC(=NC3=O)N)C4=CC=C(C=C4)CC(C(C(COC5C(C(C(O5)COP(=O)(O)OC(CCC(=O)O)C(=O)O)O)O)O)O)O)C

Names:
    C04330
    N5,N10-Methenyltetrahydromethanopterin
    5,10-Methenyltetrahydromethanopterin
    5,10-Methenyl-5,6,7,8-tetrahydromethanopterin

Registries:
    PubChem CID 440298
    PubChem ID 6982