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CHEBI:17321 - 5,6,7,8-tetrahydromethanopterin
| Formula | C30H45N6O16P |
| Net Charge | 0 |
| Average Mass | 776.690 |
| Monoisotopic Mass | 776.26297 |
| SMILES | [H][C@@]1([C@@H](C)Nc2ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]3O[C@H](COP(=O)(O)O[C@@H](CCC(=O)O)C(=O)O)[C@@H](O)[C@H]3O)cc2)Nc2c(nc(N)nc2=O)N[C@H]1C |
| InChI | InChI=1S/C30H45N6O16P/c1-12(21-13(2)33-26-22(34-21)27(44)36-30(31)35-26)32-15-5-3-14(4-6-15)9-16(37)23(41)17(38)10-49-29-25(43)24(42)19(51-29)11-50-53(47,48)52-18(28(45)46)7-8-20(39)40/h3-6,12-13,16-19,21,23-25,29,32,34,37-38,41-43H,7-11H2,1-2H3,(H,39,40)(H,45,46)(H,47,48)(H4,31,33,35,36,44)/t12-,13+,16+,17-,18+,19-,21+,23+,24-,25-,29+/m1/s1 |
| InChIKey | SCBIBGUJSMHIAI-LHIIQLEZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5,6,7,8-tetrahydromethanopterin (CHEBI:17321) is a tetrahydromethanopterin (CHEBI:26914) |
| 5,6,7,8-tetrahydromethanopterin (CHEBI:17321) is conjugate acid of 5,6,7,8-tetrahydromethanopterin(3−) (CHEBI:58103) |
| Incoming Relation(s) |
| 5,6,7,8-tetrahydromethanopterin(3−) (CHEBI:58103) is conjugate base of 5,6,7,8-tetrahydromethanopterin (CHEBI:17321) |
| IUPAC Name |
|---|
| 1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-α-D-ribofuranosyl}-D-ribitol |
| Synonyms | Source |
|---|---|
| 5,6,7,8-Tetrahydromethanopterin | KEGG COMPOUND |
| tetrahydromethanopterin | IUBMB |
| Pentitol, 1-(4-((1-(2-amino-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)-, (16alpha)- | ChemIDplus |
| 1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphonato]-α-D-ribofuranosyl}-D-ribitol | IUBMB |
| H4MPT | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C01217 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| CAS:92481-94-2 | ChemIDplus |
| CAS:92481-94-2 | KEGG COMPOUND |