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fondaparinux sodium vs 2,4-dihydroxy-3,3-dimethyl-butyrate

Input interpretation

fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate
fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate

Chemical names and formulas

 | fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate formula | C_31H_43N_3Na_10O_49S_8 | C_6H_11O_4 Hill formula | C_31H_43N_3Na_10O_49S_8 | C_6H_11O_4 name | fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate IUPAC name | decasodium (2R, 3S, 4S, 5R, 6R)-3-[(2R, 3R, 4R, 5R, 6R)-5-[(2R, 3R, 4R, 5S, 6S)-6-carboxylato-5-[(2R, 3R, 4R, 5S, 6R)-4, 5-dihydroxy-3-(sulfonatoamino)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-3, 4-dihydroxyoxan-2-yl]oxy-3-(sulfonatoamino)-4-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-hydroxy-6-[(2R, 3S, 4R, 5R, 6S)-4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-5-sulfonatooxyoxane-2-carboxylate | (2R)-2, 4-dihydroxy-3, 3-dimethylbutanoate mass fractions | C (carbon) 21.5% | H (hydrogen) 2.51% | N (nitrogen) 2.43% | Na (sodium) 13.3% | O (oxygen) 45.4% | S (sulfur) 14.8% | C (carbon) 49% | H (hydrogen) 7.54% | O (oxygen) 43.5%
| fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate formula | C_31H_43N_3Na_10O_49S_8 | C_6H_11O_4 Hill formula | C_31H_43N_3Na_10O_49S_8 | C_6H_11O_4 name | fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate IUPAC name | decasodium (2R, 3S, 4S, 5R, 6R)-3-[(2R, 3R, 4R, 5R, 6R)-5-[(2R, 3R, 4R, 5S, 6S)-6-carboxylato-5-[(2R, 3R, 4R, 5S, 6R)-4, 5-dihydroxy-3-(sulfonatoamino)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-3, 4-dihydroxyoxan-2-yl]oxy-3-(sulfonatoamino)-4-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-hydroxy-6-[(2R, 3S, 4R, 5R, 6S)-4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-5-sulfonatooxyoxane-2-carboxylate | (2R)-2, 4-dihydroxy-3, 3-dimethylbutanoate mass fractions | C (carbon) 21.5% | H (hydrogen) 2.51% | N (nitrogen) 2.43% | Na (sodium) 13.3% | O (oxygen) 45.4% | S (sulfur) 14.8% | C (carbon) 49% | H (hydrogen) 7.54% | O (oxygen) 43.5%

Structure diagrams

  | fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate vertex count | 101 | 10 edge count | 104 | 11 Schultz index | 188977 | 418 Wiener index | 46698 | 116 Hosoya index | (data not available) | 55 Balaban index | 1.577 | 4.034
| fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate vertex count | 101 | 10 edge count | 104 | 11 Schultz index | 188977 | 418 Wiener index | 46698 | 116 Hosoya index | (data not available) | 55 Balaban index | 1.577 | 4.034

3D structure

3D structure
3D structure

Basic properties

 | fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate molar mass | 1728 g/mol | 147.15 g/mol phase | liquid (at STP) | solid (at STP)
| fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate molar mass | 1728 g/mol | 147.15 g/mol phase | liquid (at STP) | solid (at STP)

Units

Hydrophobicity and permeability properties

 | fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate predicted LogP hydrophobicity | 0.72 | -0.34 predicted LogS | -2 | 0.46
| fondaparinux sodium | 2, 4-dihydroxy-3, 3-dimethyl-butyrate predicted LogP hydrophobicity | 0.72 | -0.34 predicted LogS | -2 | 0.46