5-Formyl-H4MPT

CAS Registry Number®

99451-79-3

CAS Name

5-Formyl-H4MPT

Molecular Formula

C31H45N6O17P

Molecular Mass

804.69

Cite this Page

5-Formyl-H4MPT.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=99451-79-3 (retrieved 2024-11-26) (CAS RN: 99451-79-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H45N6O17P/c1-13(22-14(2)34-27-23(37(22)12-38)28(46)36-31(32)35-27)33-16-5-3-15(4-6-16)9-17(39)24(43)18(40)10-51-30-26(45)25(44)20(53-30)11-52-55(49,50)54-19(29(47)48)7-8-21(41)42/h3-6,12-14,17-20,22,24-26,30,33,39-40,43-45H,7-11H2,1-2H3,(H,41,42)(H,47,48)(H,49,50)(H4,32,34,35,36,46)

InChIKey

InChIKey=RMPHWTMYCVTPKB-UHFFFAOYSA-N

SMILES

C(=O)N1C2=C(NC(C)C1C(NC3=CC=C(CC(C(C(COC4OC(COP(OC(CCC(O)=O)C(O)=O)(=O)O)C(O)C4O)O)O)O)C=C3)C)NC(N)=NC2=O

Canonical SMILES

O=CN1C=2C(=O)N=C(N)NC2NC(C)C1C(NC3=CC=C(C=C3)CC(O)C(O)C(O)COC4OC(COP(=O)(O)OC(C(=O)O)CCC(=O)O)C(O)C4O)C

Other Names for this Substance

  • D-Ribitol, 1-[4-[[(1R)-1-[(6S,7S)-2-amino-5-formyl-3,4,5,6,7,8-hexahydro-7-methyl-4-oxo-6-pteridinyl]ethyl]amino]phenyl]-1-deoxy-5-O-[5-O-[[(1S)-1,3-dicarboxypropoxy]hydroxyphosphinyl]-α-D-ribofuranosyl]-
  • D-Ribitol, 1-[4-[[1-(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-7-methyl-4-oxo-6-pteridinyl)ethyl]amino]phenyl]-1-deoxy-5-O-[5-O-[(1,3-dicarboxypropoxy)hydroxyphosphinyl]-α-D-ribofuranosyl]-, [1[R(6S,7S)],5(S)]-
  • D-Ribitol, 1-[4-[[(1R)-1-[(6S,7S)-2-amino-5-formyl-1,4,5,6,7,8-hexahydro-7-methyl-4-oxo-6-pteridinyl]ethyl]amino]phenyl]-1-deoxy-5-O-[5-O-[[(1S)-1,3-dicarboxypropoxy]hydroxyphosphinyl]-α-D-ribofuranosyl]-
  • 1-[4-[[(1R)-1-[(6S,7S)-2-Amino-5-formyl-3,4,5,6,7,8-hexahydro-7-methyl-4-oxo-6-pteridinyl]ethyl]amino]phenyl]-1-deoxy-5-O-[5-O-[[(1S)-1,3-dicarboxypropoxy]hydroxyphosphinyl]-α-D-ribofuranosyl]-D-ribitol
  • N5-Formyltetrahydromethanopterin

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