| DL7 | Name: | (5beta,14beta,17alpha,25R)-3-oxocholest-7-en-26-oic acid | Formula: | C27 H42 O3 | SMILES: | O=C(O)C(C)CCCC(C)C4C3(CCC1C(=CCC2CC(=O)CCC12C)C3CC4)C | InChi: | InChI=1S/C27H42O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h9,17-19,22-24H,5-8,10-16H2,1-4H3,(H,29,30)/t17-,18-,19+,22-,23+,24+,26+,27-/m1/s1 | Definition date: | 2009-04-06 | Last modified: | 2011-06-04 | Identifier: | (5beta,14beta,17alpha,25R)-3-oxocholest-7-en-26-oic acid |
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| DL8 | Name: | N-[(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)ACETYL]-BETA-D-GLUCOPYRANOSYLAMINE | Formula: | C16 H20 N4 O6 | SMILES: | O=C(NC1OC(C(O)C(O)C1O)CO)Cn3nnc(c2ccccc2)c3 | InChi: | InChI=1S/C16H20N4O6/c21-8-11-13(23)14(24)15(25)16(26-11)17-12(22)7-20-6-10(18-19-20)9-4-2-1-3-5-9/h1-6,11,13-16,21,23-25H,7-8H2,(H,17,22)/t11-,13-,14+,15-,16-/m1/s1 | Definition date: | 2007-05-29 | Last modified: | 2011-06-04 | Identifier: | N-[(4-phenyl-1H-1,2,3-triazol-1-yl)acetyl]-beta-D-glucopyranosylamine |
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| DLL | Name: | 5'-O-[HYDROXY(PHENYLACETYL)PHOSPHORYL]ADENOSINE | Formula: | C18 H20 N5 O8 P | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CO[P](O)(=O)OC(=O)Cc4ccccc4)[CH](O)[CH]3O | InChi: | InChI=1S/C18H20N5O8P/c19-16-13-17(21-8-20-16)23(9-22-13)18-15(26)14(25)11(30-18)7-29-32(27,28)31-12(24)6-10-4-2-1-3-5-10/h1-5,8-9,11,14-15,18,25-26H,6-7H2,(H,27,28)(H2,19,20,21)/t11-,14-,15-,18-/m1/s1 | Definition date: | 2010-12-15 | Last modified: | 2011-06-04 | Identifier: | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] 2-phenylethanoate |
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| DLN | Name: | 3-{[4-amino-1-(1-methylethyl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]ethynyl}phenol | Formula: | C16 H15 N5 O | SMILES: | n1c(c3c(nc1)n(nc3C#Cc2cccc(O)c2)C(C)C)N | InChi: | InChI=1S/C16H15N5O/c1-10(2)21-16-14(15(17)18-9-19-16)13(20-21)7-6-11-4-3-5-12(22)8-11/h3-5,8-10,22H,1-2H3,(H2,17,18,19) | Definition date: | 2009-11-09 | Last modified: | 2011-06-04 | Identifier: | 3-{[4-amino-1-(1-methylethyl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]ethynyl}phenol |
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| DM3 | Name: | 6-DEOXYDAUNOMYCIN | Formula: | C27 H29 N O9 | SMILES: | O=C2c1cc5c(c(O)c1C(=O)c3c2cccc3OC)C(OC4OC(C(O)C(N)C4)C)CC(O)(C(=O)C)C5 | InChi: | InChI=1S/C27H29NO9/c1-11-23(30)16(28)8-19(36-11)37-18-10-27(34,12(2)29)9-13-7-15-22(25(32)20(13)18)26(33)21-14(24(15)31)5-4-6-17(21)35-3/h4-7,11,16,18-19,23,30,32,34H,8-10,28H2,1-3H3/t11-,16-,18-,19-,23+,27-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | (1S,3S)-3-acetyl-3,12-dihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside |
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| DM4 | Name: | 1-O-DEMETHYL-6-DEOXYDOXORUBICIN | Formula: | C26 H27 N O10 | SMILES: | O=C2c1cc5c(c(O)c1C(=O)c3c2cccc3O)C(OC4OC(C(O)C(N)C4)C)CC(O)(C(=O)CO)C5 | InChi: | InChI=1S/C26H27NO10/c1-10-22(31)14(27)6-18(36-10)37-16-8-26(35,17(30)9-28)7-11-5-13-21(24(33)19(11)16)25(34)20-12(23(13)32)3-2-4-15(20)29/h2-5,10,14,16,18,22,28-29,31,33,35H,6-9,27H2,1H3/t10-,14-,16-,18-,22+,26-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | (1S,3S)-3,10,12-trihydroxy-3-(hydroxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside |
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| DM9 | Name: | N-HYDROXYMETHYL-N-(2-METHOXYETHYL)-DAUNOMYCIN | Formula: | C31 H39 N O12 | SMILES: | O=C(C)C5(O)CC(OC1OC(C(O)C(N(CCOC)CO)C1)C)c4c(O)c3c(O)c2c(OC)cccc2c(O)c3c(O)c4C5 | InChi: | InChI=1S/C31H39NO12/c1-14-26(35)18(32(13-33)8-9-41-3)10-21(43-14)44-20-12-31(40,15(2)34)11-17-23(20)30(39)25-24(28(17)37)27(36)16-6-5-7-19(42-4)22(16)29(25)38/h5-7,14,18,20-21,26,33,35-40H,8-13H2,1-4H3/t14-,18-,20-,21-,26+,31-/m0/s1 | Definition date: | 1999-07-30 | Last modified: | 2011-06-04 | Identifier: | (1S,3S)-3-acetyl-3,5,6,11,12-pentahydroxy-10-methoxy-1,2,3,4-tetrahydrotetracen-1-yl 2,3,6-trideoxy-3-[(hydroxymethyl)(2-methoxyethyl)amino]-alpha-L-lyxo-hexopyranoside |
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| DMM | Name: | 3'-DESAMINO-3'-(2-METHOXY-4-MORPHOLINYL)-DOXORUBICIN | Formula: | C32 H37 N O13 | SMILES: | O=C2c1c(O)c6c(c(O)c1C(=O)c3cccc(OC)c23)CC(O)(C(=O)CO)CC6OC5OC(C)C(O)C(N4CCOC(OC)C4)C5 | InChi: | InChI=1S/C32H37NO13/c1-14-27(36)17(33-7-8-44-22(12-33)43-3)9-21(45-14)46-19-11-32(41,20(35)13-34)10-16-24(19)31(40)26-25(29(16)38)28(37)15-5-4-6-18(42-2)23(15)30(26)39/h4-6,14,17,19,21-22,27,34,36,38,40-41H,7-13H2,1-3H3/t14-,17-,19-,21-,22-,27+,32-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | (1S,3S)-3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-[(2S)-2-methoxymorpholin-4-yl]-alpha-L-lyxo-hexopyranoside |
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| DMS | Name: | DIMETHYL SULFOXIDE | Formula: | C2 H6 O S | SMILES: | sulfinyldimethane | InChi: | InChI=1S/C2H6OS/c1-4(2)3/h1-2H3 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | dimethyl sulfoxide |
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| DMX | Name: | 3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE | Formula: | C12 H19 N O3 S | SMILES: | [O-]S(=O)(=O)CCC[N+](C)(Cc1ccccc1)C | InChi: | InChI=1S/C12H19NO3S/c1-13(2,9-6-10-17(14,15)16)11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11H2,1-2H3 | Definition date: | 2004-06-28 | Last modified: | 2011-06-04 | Identifier: | 3-[benzyl(dimethyl)ammonio]propane-1-sulfonate |
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| DN | Name: | UNKNOWN 2'-DEOXYNUCLEOTIDE | Formula: | C5 H11 O6 P | SMILES: | O=P(OCC1OCCC1O)(O)O | InChi: | InChI=1S/C5H11O6P/c6-4-1-2-10-5(4)3-11-12(7,8)9/h4-6H,1-3H2,(H2,7,8,9)/t4-,5+/m0/s1 | Definition date: | 2010-06-02 | Last modified: | 2011-06-04 | Identifier: | 1,4-anhydro-2-deoxy-5-O-phosphono-D-erythro-pentitol |
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| DNC | Name: | 3,5-DINITROCATECHOL | Formula: | C6 H4 N2 O6 | SMILES: | [O-][N+](=O)c1cc([N+]([O-])=O)cc(O)c1O | InChi: | InChI=1S/C6H4N2O6/c9-5-2-3(7(11)12)1-4(6(5)10)8(13)14/h1-2,9-10H | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | 3,5-dinitrobenzene-1,2-diol |
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| DNF | Name: | 2,4-DINITROPHENOL | Formula: | C6 H4 N2 O5 | SMILES: | O=[N+]([O-])c1cc(ccc1O)[N+]([O-])=O | InChi: | InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H | Definition date: | 2002-02-22 | Last modified: | 2011-06-04 | Identifier: | 2,4-dinitrophenol |
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| DNR | Name: | 2'-DEOXY-N3-PROTONATED CYTIDINE-5'-MONOPHOSPHATE | Formula: | C9 H15 N3 O7 P | SMILES: | O=C1[NH+]=C(N)C=CN1C2OC(C(O)C2)COP(=O)(O)O | InChi: | InChI=1S/C9H14N3O7P/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(19-8)4-18-20(15,16)17/h1-2,5-6,8,13H,3-4H2,(H2,10,11,14)(H2,15,16,17)/p+1/t5-,6+,8+/m0/s1 | Definition date: | 2002-04-04 | Last modified: | 2011-06-04 | Identifier: | 2'-deoxy-5'-cytidylic acid |
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| DOB | Name: | 2,4-DIHYDROXYBENZOIC ACID | Formula: | C7 H6 O4 | SMILES: | O=C(O)c1ccc(O)cc1O | InChi: | InChI=1S/C7H6O4/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,8-9H,(H,10,11) | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | 2,4-dihydroxybenzoic acid |
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| DOC | Name: | 2',3'-DIDEOXYCYTIDINE-5'-MONOPHOSPHATE | Formula: | C9 H14 N3 O6 P | SMILES: | O=C1N=C(N)C=CN1C2OC(CC2)COP(=O)(O)O | InChi: | InChI=1S/C9H14N3O6P/c10-7-3-4-12(9(13)11-7)8-2-1-6(18-8)5-17-19(14,15)16/h3-4,6,8H,1-2,5H2,(H2,10,11,13)(H2,14,15,16)/t6-,8+/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | [(2S,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
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| DOE | Name: | (S)-2-(4-(2-(2-HYDROXYETHYLTHIO)-ACETAMIDO)-BENZYL)-1,4,7,10-TETRAAZACYCLODODECANE-N,N',N'',N'''-TETRAACETATE | Formula: | C27 H41 N5 O10 S | SMILES: | O=C(Nc1ccc(cc1)CC2N(CCN(CCN(CCN(CC(=O)O)C2)CC(=O)O)CC(=O)O)CC(=O)O)CSCCO | InChi: | InChI=1S/C27H41N5O10S/c33-11-12-43-19-23(34)28-21-3-1-20(2-4-21)13-22-14-31(17-26(39)40)8-7-29(15-24(35)36)5-6-30(16-25(37)38)9-10-32(22)18-27(41)42/h1-4,22,33H,5-19H2,(H,28,34)(H,35,36)(H,37,38)(H,39,40)(H,41,42)/t22-/m0/s1 | Definition date: | 2002-12-12 | Last modified: | 2011-06-04 | Identifier: | 2,2',2'',2'''-{(2S)-2-[4-({[(2-hydroxyethyl)sulfanyl]acetyl}amino)benzyl]-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl}tetraacetic acid |
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| DOF | Name: | (S)-2-(4-NITROBENZYL)-1,4,7,10-TETRAAZACYCLODODECANE-N,N',N'',N'''-TETRAACETATE | Formula: | C23 H33 N5 O10 | SMILES: | [O-][N+](=O)c1ccc(cc1)CC2N(CCN(CCN(CCN(CC(=O)O)C2)CC(=O)O)CC(=O)O)CC(=O)O | InChi: | InChI=1S/C23H33N5O10/c29-20(30)13-24-5-6-25(14-21(31)32)9-10-27(16-23(35)36)19(12-26(8-7-24)15-22(33)34)11-17-1-3-18(4-2-17)28(37)38/h1-4,19H,5-16H2,(H,29,30)(H,31,32)(H,33,34)(H,35,36)/t19-/m0/s1 | Definition date: | 2002-12-12 | Last modified: | 2011-06-04 | Identifier: | 2,2',2'',2'''-[(2S)-2-(4-nitrobenzyl)-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl]tetraacetic acid |
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| DP3 | Name: | N-{(4S)-4-AMINO-5-[(2-AMINOETHYL)AMINO]PENTYL}-N'-NITROGUANIDINE | Formula: | C8 H21 N7 O2 | SMILES: | [O-][N+](=O)NC(=[N@H])NCCCC(N)CNCCN | InChi: | InChI=1S/C8H21N7O2/c9-3-5-12-6-7(10)2-1-4-13-8(11)14-15(16)17/h7,12H,1-6,9-10H2,(H3,11,13,14)/t7-/m0/s1 | Definition date: | 2003-05-05 | Last modified: | 2011-06-04 | Identifier: | 1-{(4S)-4-amino-5-[(2-aminoethyl)amino]pentyl}-3-nitroguanidine |
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| DP7 | Name: | AC-(D)PHE-PRO-BOROARG-OH | Formula: | C21 H33 B N6 O5 | SMILES: | O=C(NC(B(O)O)CCCNC(=[N@H])N)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2 | InChi: | InChI=1S/C21H33BN6O5/c1-14(29)26-16(13-15-7-3-2-4-8-15)20(31)28-12-6-9-17(28)19(30)27-18(22(32)33)10-5-11-25-21(23)24/h2-4,7-8,16-18,32-33H,5-6,9-13H2,1H3,(H,26,29)(H,27,30)(H4,23,24,25)/t16-,17+,18+/m1/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | N-acetyl-D-phenylalanyl-N-[(1R)-4-carbamimidamido-1-(dihydroxyboranyl)butyl]-L-prolinamide |
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| DPA | Name: | 4,5-DIMETHOXY-N-(2'-METHOXYPROPENOYL ANTHRANILATE) | Formula: | C13 H15 N O5 | SMILES: | O=C(C(OC)=C)Nc1cc(OC)c(OC)cc1C=O | InChi: | InChI=1S/C13H15NO5/c1-8(17-2)13(16)14-10-6-12(19-4)11(18-3)5-9(10)7-15/h5-7H,1H2,2-4H3,(H,14,16) | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | N-(2-formyl-4,5-dimethoxyphenyl)-2-methoxyprop-2-enamide |
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| DPD | Name: | N-(3,3,-DIPHENYLPROPYL)-N'-[1-R-(2 3,4-BIS-BUTOXYPHENYL)-ETHYL]-PROPYLENEDIAMINE | Formula: | C34 H48 N2 O2 | SMILES: | O(c1cc(ccc1OCCCC)C(NCCCNCCC(c2ccccc2)c3ccccc3)C)CCCC | InChi: | InChI=1S/C34H48N2O2/c1-4-6-25-37-33-20-19-31(27-34(33)38-26-7-5-2)28(3)36-23-14-22-35-24-21-32(29-15-10-8-11-16-29)30-17-12-9-13-18-30/h8-13,15-20,27-28,32,35-36H,4-7,14,21-26H2,1-3H3/t28-/m1/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | N-[(1R)-1-(3,4-dibutoxyphenyl)ethyl]-N'-(3,3-diphenylpropyl)propane-1,3-diamine |
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| DPS | Name: | 3-(1H-INDOL-3-YL)-2-[4-(4-PHENYL-PIPERIDIN-1-YL)-BENZENESULFONYLAMINO]-PROPIONIC ACID | Formula: | C28 H29 N3 O4 S | SMILES: | O=C(O)C(NS(=O)(=O)c1ccc(cc1)N3CCC(c2ccccc2)CC3)Cc5c4ccccc4nc5 | InChi: | InChI=1S/C28H29N3O4S/c32-28(33)27(18-22-19-29-26-9-5-4-8-25(22)26)30-36(34,35)24-12-10-23(11-13-24)31-16-14-21(15-17-31)20-6-2-1-3-7-20/h1-13,19,21,27,29-30H,14-18H2,(H,32,33)/t27-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2011-06-04 | Identifier: | N-{[4-(4-phenylpiperidin-1-yl)phenyl]sulfonyl}-L-tryptophan |
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| DPW | Name: | decyl 2-trimethylazaniumylethyl phosphate | Formula: | C15 H34 N O4 P | SMILES: | [O-]P(=O)(OCCCCCCCCCC)OCC[N+](C)(C)C | InChi: | InChI=1S/C15H34NO4P/c1-5-6-7-8-9-10-11-12-14-19-21(17,18)20-15-13-16(2,3)4/h5-15H2,1-4H3 | Definition date: | 2008-12-03 | Last modified: | 2011-06-04 | Identifier: | decyl 2-(trimethylammonio)ethyl phosphate |
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| DPY | Name: | 2-DEOXYRIBOFURANOSYL-PYRIDINE-2,6-DICARBOXYLIC ACID-5'-MONOPHOSPHATE | Formula: | C12 H14 N O10 P | SMILES: | O=P(OCC2OC(c1ccc(nc1C(=O)O)C(=O)O)CC2O)(O)O | InChi: | InChI=1S/C12H14NO10P/c14-7-3-8(23-9(7)4-22-24(19,20)21)5-1-2-6(11(15)16)13-10(5)12(17)18/h1-2,7-9,14H,3-4H2,(H,15,16)(H,17,18)(H2,19,20,21)/t7-,8+,9+/m0/s1 | Definition date: | 2001-06-25 | Last modified: | 2011-06-04 | Identifier: | (1R)-1,4-anhydro-2-deoxy-1-(2,6-dicarboxypyridin-3-yl)-5-O-phosphono-D-erythro-pentitol |
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