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Substance Name: 5-Formyl-5,6,7,8-tetrahydromethanopterin
RN: 99451-79-3
InChIKey: RMPHWTMYCVTPKB-UHFFFAOYSA-N

Molecular Formula

  • C31-H45-N6-O17-P

Molecular Weight

  • 804.695
 
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Names and Synonyms

Name of Substance

  • 5-Formyl-5,6,7,8-tetrahydromethanopterin

Synonyms

  • 5-Formyl-H4MPT
  • N(5)-Formyltetrahydromethanopterin

Systematic Name

  • Pentitol, 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)-alpha-D-ribofuranosyl)-

Registry Numbers

CAS Registry Number

  • 99451-79-3

System Generated Number

  • 0099451793

Structure Descriptors

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

RMPHWTMYCVTPKB-UHFFFAOYSA-N

Smiles

O([C@@H](CCC(O)=O)C(O)=O)[P@@](OC[C@@H]1[C@@H]([C@@H]([C@@H](OC[C@@H]([C@@H]([C@@H](Cc2ccc(N[C@@H]([C@@H]3[C@@H](Nc4[nH]c(nc(c4N3C=O)=O)N)C)C)cc2)O)O)O)O1)O)O)(O)=O