| Identification | Back Directory | [Name]
1,4-Dihydronicotinamide mononucleotide | [CAS]
4229-56-5 | [Synonyms]
1,4-Dihydronicotinamide mononucleotide
((2R,3S,4R,5R)-5-(3-Carbamoylpyridin-1(4H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate | [Molecular Formula]
C11H17N2O8P | [MDL Number]
MFCD32856535 | [MOL File]
4229-56-5.mol | [Molecular Weight]
336.23 |
| Chemical Properties | Back Directory | [Boiling point ]
724.0±70.0 °C(Predicted) | [density ]
1.728±0.06 g/cm3(Predicted) | [pka]
1.86±0.10(Predicted) | [InChI]
InChI=1S/C11H17N2O8P/c12-10(16)6-2-1-3-13(4-6)11-9(15)8(14)7(21-11)5-20-22(17,18)19/h1,3-4,7-9,11,14-15H,2,5H2,(H2,12,16)(H2,17,18,19)/t7-,8-,9-,11-/m1/s1 | [InChIKey]
XQHMUSRSLNRVGA-TURQNECASA-N | [SMILES]
C1N([C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2O)C=CCC=1C(N)=O |
| Hazard Information | Back Directory | [Definition]
ChEBI: NMNH is a nicotinamide mononucleotide that is obtained by addition of hydride to position 4 on the pyridine ring of NMN(+). It has a role as a metabolite. It is functionally related to a NMN(+). It is a conjugate acid of a NMNH(2-). |
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