3-[(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl]-2-{(S)-Hydroxy[Hydroxy(Methoxy)Phosphoryl]Phenylmethyl}-5-(2-{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Ethyl)-4-Methyl-1,3-Thiazol-3-Ium

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Properties Simple | Detailed

Formula C20H30N4O11P3S
IUPAC Name [(s)-[3-[(4-amino-2-methyl-pyrimidine-1,3-diium-5-id-5-yl)methyl]-5-[2-[hydroxy(phosphonooxy)phosphoryl]oxyethyl]-4-methyl-thiazol-2-id-2-yl]-hydroxy-phenyl-methyl]-methoxy-phosphinic acid
Molecular Mass 627.459 g·mol−1
Heat of Formation -2582.8 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 649.7 Å 3
Surface Area 467.64 Å 2
Point Group Symmetry C1
InChIKey NEEQBMRCDKRNBV-FQEVSTJZSA-O
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