 | | TYM | | Name: | TRYPTOPHANYL-5'AMP | | Formula: | C21 H24 N7 O8 P | | SMILES: | O=C(OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3O)C(N)Cc5c4ccccc4nc5 | | InChi: | InChI=1S/C21H24N7O8P/c22-12(5-10-6-24-13-4-2-1-3-11(10)13)21(31)36-37(32,33)34-7-14-16(29)17(30)20(35-14)28-9-27-15-18(23)25-8-26-19(15)28/h1-4,6,8-9,12,14,16-17,20,24,29-30H,5,7,22H2,(H,32,33)(H2,23,25,26)/t12-,14+,16+,17+,20+/m0/s1 | | Definition date: | 2001-03-08 | | Last modified: | 2011-06-04 | | Identifier: | 5'-O-[(R)-{[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]oxy}(hydroxy)phosphoryl]adenosine |
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 | | BRX | | Name: | BROMAMPHENICOL | | Formula: | C11 H12 Br2 N2 O5 | | SMILES: | BrC(Br)C(=O)NC(C(O)c1ccc([N+]([O-])=O)cc1)CO | | InChi: | InChI=1S/C11H12Br2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1 | | Definition date: | 2008-08-28 | | Last modified: | 2011-06-04 | | Identifier: | 2,2-dibromo-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide |
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 | | CAE | | Name: | CAMPHANE | | Formula: | C10 H18 | | SMILES: | CC2(C)C1CCC2(CC1)C | | InChi: | InChI=1S/C10H18/c1-9(2)8-4-6-10(9,3)7-5-8/h8H,4-7H2,1-3H3/t8-,10+ | | Definition date: | 2001-01-26 | | Last modified: | 2011-06-04 | | Identifier: | (1s,4s)-1,7,7-trimethylbicyclo[2.2.1]heptane |
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 | | CAH | | Name: | 5-EXO-HYDROXYCAMPHOR | | Formula: | C10 H16 O2 | | SMILES: | O=C1CC2C(C)(C1(CC2O)C)C | | InChi: | InChI=1S/C10H16O2/c1-9(2)6-4-8(12)10(9,3)5-7(6)11/h6-7,11H,4-5H2,1-3H3/t6-,7+,10-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | (1R,4R,5R)-5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one |
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 | | CAM | | Name: | CAMPHOR | | Formula: | C10 H16 O | | SMILES: | O=C1CC2CCC1(C)C2(C)C | | InChi: | InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | (1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one |
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 | | CHF | | Name: | CYCLOHEXYLFLUOROSTATONE | | Formula: | C11 H19 F2 N O4 | | SMILES: | O=C(O)C(F)(F)C(O)(O)C(N)CC1CCCCC1 | | InChi: | InChI=1S/C11H19F2NO4/c12-10(13,9(15)16)11(17,18)8(14)6-7-4-2-1-3-5-7/h7-8,17-18H,1-6,14H2,(H,15,16)/t8-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | (4S)-4-amino-5-cyclohexyl-2,2-difluoro-3,3-dihydroxypentanoic acid |
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 | | CL8 | | Name: | CHLORAMPHENICOL SUCCINATE | | Formula: | C15 H16 Cl2 N2 O8 | | SMILES: | ClC(Cl)C(=O)NC(C(O)c1ccc([N+]([O-])=O)cc1)COC(=O)CCC(=O)O | | InChi: | InChI=1S/C15H16Cl2N2O8/c16-14(17)15(24)18-10(7-27-12(22)6-5-11(20)21)13(23)8-1-3-9(4-2-8)19(25)26/h1-4,10,13-14,23H,5-7H2,(H,18,24)(H,20,21)/t10-,13-/m1/s1 | | Definition date: | 2008-08-28 | | Last modified: | 2011-06-04 | | Identifier: | 4-{[(2R,3R)-2-[(dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl]oxy}-4-oxobutanoic acid |
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 | | CLM | | Name: | CHLORAMPHENICOL | | Formula: | C11 H12 Cl2 N2 O5 | | SMILES: | ClC(Cl)C(=O)NC(C(O)c1ccc([N+]([O-])=O)cc1)CO | | InChi: | InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | 2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide |
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 | | T32 | | Name: | 6'-ALPHA-METHYL CARBOCYCLIC THYMIDINE 5'-MONOPHOSPHATE | | Formula: | C12 H19 N2 O7 P | | SMILES: | O=P(O)(O)OCC2C(C(N1C=C(C(=O)NC1=O)C)CC2O)C | | InChi: | InChI=1S/C12H19N2O7P/c1-6-4-14(12(17)13-11(6)16)9-3-10(15)8(7(9)2)5-21-22(18,19)20/h4,7-10,15H,3,5H2,1-2H3,(H,13,16,17)(H2,18,19,20)/t7-,8-,9-,10-/m0/s1 | | Definition date: | 1996-12-07 | | Last modified: | 2011-06-04 | | Identifier: | [(1R,2S,3S,5S)-5-hydroxy-2-methyl-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)cyclopentyl]methyl dihydrogen phosphate |
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 | | AN2 | | Name: | AMP PHOSPHORAMIDATE | | Formula: | C10 H16 N6 O9 P2 | | SMILES: | O=P(O)(OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3O)N | | InChi: | InChI=1S/C10H16N6O9P2/c11-8-5-9(14-2-13-8)16(3-15-5)10-7(18)6(17)4(24-10)1-23-27(21,22)25-26(12,19)20/h2-4,6-7,10,17-18H,1H2,(H,21,22)(H2,11,13,14)(H3,12,19,20)/t4-,6-,7-,10-/m1/s1 | | Definition date: | 2004-12-17 | | Last modified: | 2011-06-04 | | Identifier: | 5'-O-[(S)-{[(S)-amino(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine |
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 | | 4NL | | Name: | 4-AMINOPHENOL | | Formula: | C6 H7 N O | | SMILES: | Oc1ccc(N)cc1 | | InChi: | InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2 | | Definition date: | 2007-02-05 | | Last modified: | 2011-06-04 | | Identifier: | 4-aminophenol |
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 | | 6CT | | Name: | PHOSPHORIC ACID MONO-[5-HYDROXYMETHYL-2-METHYL-3-THYMINYL-CYCLOPENTYLMETHYL]ESTER GROUP | | Formula: | C12 H19 N2 O7 P | | SMILES: | O=P(O)(O)OCC2C(C(N1C=C(C(=O)NC1=O)C)CC2O)C | | InChi: | InChI=1/C12H19N2O7P/c1-6-4-14(12(17)13-11(6)16)9-3-10(15)8(7(9)2)5-21-22(18,19)20/h4,7-10,15H,3,5H2,1-2H3,(H,13,16,17)(H2,18,19,20)/t7-,8-,9-,10-/m0/s1/f/h13,18-19H | | Definition date: | 1999-07-08 | | Last modified: | 2009-09-15 | | Identifier: | [(1R,2S,3S,5S)-5-hydroxy-2-methyl-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)cyclopentyl]methyl dihydrogen phosphate |
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