 | | EEN | | Name: | 2-deoxy-2-[(difluoroacetyl)amino]-alpha-D-galactopyranose | | Formula: | C8 H13 F2 N O6 | | SMILES: | OC[CH]1O[CH](O)[CH](NC(=O)C(F)F)[CH](O)[CH]1O | | InChi: | InChI=1S/C8H13F2NO6/c9-6(10)7(15)11-3-5(14)4(13)2(1-12)17-8(3)16/h2-6,8,12-14,16H,1H2,(H,11,15)/t2-,3-,4+,5-,8+/m1/s1 | | Synonyms: | N-DIFLUOROACETYL-D-GALACTOSAMINE | | Definition date: | 2018-03-16 | | Last modified: | 2024-09-27 | | Release date: | 2019-02-20 | | Identifier: | 2,2-bis(fluoranyl)-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide |
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 | | EEQ | | Name: | 2-deoxy-2-[(fluoroacetyl)amino]-alpha-D-galactopyranose | | Formula: | C8 H14 F N O6 | | SMILES: | OC[CH]1O[CH](O)[CH](NC(=O)CF)[CH](O)[CH]1O | | InChi: | InChI=1S/C8H14FNO6/c9-1-4(12)10-5-7(14)6(13)3(2-11)16-8(5)15/h3,5-8,11,13-15H,1-2H2,(H,10,12)/t3-,5-,6+,7-,8+/m1/s1 | | Synonyms: | 2-fluoranyl-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide | | Definition date: | 2018-03-16 | | Last modified: | 2024-09-27 | | Release date: | 2019-02-20 | | Identifier: | 2-fluoranyl-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide |
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 | | AMU | | Name: | N-acetyl-beta-muramic acid | | Formula: | C11 H19 N O8 | | SMILES: | O=C(O)C(OC1C(O)C(OC(O)C1NC(=O)C)CO)C | | InChi: | InChI=1S/C11H19NO8/c1-4(10(16)17)19-9-7(12-5(2)14)11(18)20-6(3-13)8(9)15/h4,6-9,11,13,15,18H,3H2,1-2H3,(H,12,14)(H,16,17)/t4-,6-,7-,8-,9-,11-/m1/s1 | | Synonyms: | N-acetyl-muramic acid | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 2-(acetylamino)-3-O-[(1R)-1-carboxyethyl]-2-deoxy-beta-D-glucopyranose |
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 | | AMV | | Name: | methyl 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-beta-D-glucopyranoside | | Formula: | C12 H21 N O8 | | SMILES: | O=C(O)C(OC1C(O)C(OC(OC)C1NC(=O)C)CO)C | | InChi: | InChI=1S/C12H21NO8/c1-5(11(17)18)20-10-8(13-6(2)15)12(19-3)21-7(4-14)9(10)16/h5,7-10,12,14,16H,4H2,1-3H3,(H,13,15)(H,17,18)/t5-,7-,8-,9-,10-,12-/m1/s1 | | Synonyms: | METHYL 2-(ACETYLAMINO)-3-O-[(1R)-1-CARBOXYETHYL]-2-DEOXY-BETA-D-GLUCOPYRANOSIDE | | Definition date: | 2006-10-25 | | Last modified: | 2024-09-27 | | Identifier: | methyl 2-(acetylamino)-3-O-[(1R)-1-carboxyethyl]-2-deoxy-beta-D-glucopyranoside |
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 | | AR0 | | Name: | 4-amino-1-{[amino(iminio)methyl]amino}-6-[4-(carboxymethyl)pyridinium-1-yl]-1,2,3,4,6-pentadeoxy-D-erythro-hexitol | | Formula: | C14 H25 N5 O3 | | SMILES: | O=C(O)Cc1cc[n+](cc1)CC(O)C(N)CCCNC(=[NH2+])N | | InChi: | InChI=1S/C14H23N5O3/c15-11(2-1-5-18-14(16)17)12(20)9-19-6-3-10(4-7-19)8-13(21)22/h3-4,6-7,11-12,20H,1-2,5,8-9,15H2,(H4-,16,17,18,21,22)/p+2/t11-,12+/m0/s1 | | Definition date: | 2010-09-17 | | Last modified: | 2024-09-27 | | Identifier: | 4-amino-1-{[amino(iminio)methyl]amino}-6-[4-(carboxymethyl)pyridinium-1-yl]-1,2,3,4,6-pentadeoxy-D-erythro-hexitol |
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 | | ASO | | Name: | 1,5-anhydro-D-glucitol | | Formula: | C6 H12 O5 | | SMILES: | OC1C(OCC(O)C1O)CO | | InChi: | InChI=1S/C6H12O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-10H,1-2H2/t3-,4+,5+,6+/m0/s1 | | Synonyms: | 1,5-ANHYDROSORBITOL | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 1,5-anhydro-D-glucitol |
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 | | AWX | | Name: | N-({4-[4-amino-3-(3,5-dimethyl-1-benzofuran-2-yl)-7-oxo-6,7-dihydro-2H-pyrazolo[3,4-d]pyridazin-2-yl]phenyl}methyl)prop-2-enamide | | Formula: | C25 H22 N6 O3 | | SMILES: | C=[C@H]C(=O)NCc1ccc(cc1)n4c(c2oc3c(c2C)cc(C)cc3)c5c(n4)C(NN=C5N)=O | | InChi: | InChI=1S/C25H22N6O3/c1-4-19(32)27-12-15-6-8-16(9-7-15)31-22(20-21(30-31)25(33)29-28-24(20)26)23-14(3)17-11-13(2)5-10-18(17)34-23/h4-11H,1,12H2,2-3H3,(H2,26,28)(H,27,32)(H,29,33) | | Definition date: | 2018-12-04 | | Last modified: | 2024-09-27 | | Release date: | 2019-10-23 | | Identifier: | N-({4-[4-amino-3-(3,5-dimethyl-1-benzofuran-2-yl)-7-oxo-6,7-dihydro-2H-pyrazolo[3,4-d]pyridazin-2-yl]phenyl}methyl)prop-2-enamide |
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 | | END | | Name: | 1,6:5,9:8,12:11,16-TETRAANHYDRO-2,3,4,10,13,14-HEXADEOXY-D-GLYCERO-D-ALLO-D-GULO-HEPTADECA-2,13-DIENITOL | | Formula: | C17 H24 O7 | | SMILES: | O2C(C(O)C=CC3OC1C(O)C4OCC=CCC4OC1CC23)CO | | InChi: | InChI=1S/C17H24O7/c18-8-14-9(19)4-5-10-12(23-14)7-13-17(24-10)15(20)16-11(22-13)3-1-2-6-21-16/h1-2,4-5,9-20H,3,6-8H2/t9-,10+,11-,12-,13+,14+,15+,16-,17+/m0/s1 | | Definition date: | 2007-10-03 | | Last modified: | 2024-09-27 | | Identifier: | 1,6:5,9:8,12:11,16-tetraanhydro-2,3,4,10,13,14-hexadeoxy-D-glycero-D-allo-D-gulo-heptadeca-2,13-dienitol |
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 | | ENJ | | Name: | (4S)-5-methanethioyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-4-sulfo-1,4-dihydropyridine-3-carbothioic S-acid | | Formula: | C12 H16 N O11 P S3 | | SMILES: | O=C(C1=CN(C=C(C=S)C1S(=O)(=O)O)C2OC(C(C2O)O)COP(O)(O)=O)S | | InChi: | InChI=1S/C12H16NO11PS3/c14-8-7(3-23-25(17,18)19)24-11(9(8)15)13-1-5(4-26)10(28(20,21)22)6(2-13)12(16)27/h1-2,4,7-11,14-15H,3H2,(H,16,27)(H2,17,18,19)(H,20,21,22)/t7-,8-,9-,10-,11-/m1/s1 | | Definition date: | 2018-01-23 | | Last modified: | 2024-09-27 | | Release date: | 2018-03-14 | | Identifier: | (4S)-5-methanethioyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-4-sulfo-1,4-dihydropyridine-3-carbothioic S-acid |
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 | | EPG | | Name: | (2R)-oxiran-2-ylmethyl alpha-D-glucopyranoside | | Formula: | C9 H16 O7 | | SMILES: | O(CC1OC1)C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C9H16O7/c10-1-5-6(11)7(12)8(13)9(16-5)15-3-4-2-14-4/h4-13H,1-3H2/t4-,5-,6-,7+,8-,9+/m1/s1 | | Synonyms: | 2-HYDROXYMETHYL-6-OXIRANYLMETHOXY-TETRAHYDRO-PYRAN-3,4,5-TRIOL | | Definition date: | 2002-11-28 | | Last modified: | 2024-09-27 | | Identifier: | (2R)-oxiran-2-ylmethyl alpha-D-glucopyranoside |
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 | | DDO | | Name: | 6-HYDROXY-D-NORLEUCINE | | Formula: | C6 H13 N O3 | | SMILES: | O=C(O)C(N)CCCCO | | InChi: | InChI=1S/C6H13NO3/c7-5(6(9)10)3-1-2-4-8/h5,8H,1-4,7H2,(H,9,10)/t5-/m1/s1 | | Definition date: | 2001-09-11 | | Last modified: | 2024-09-27 | | Identifier: | 6-hydroxy-D-norleucine |
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 | | DEU | | Name: | CO(III)-(DEUTEROPORPHYRIN IX) | | Formula: | C30 H28 Co N4 O4 | | SMILES: | O=C(O)CCC1=C(c4[n+]3C1=Cc8c(c(c7cc2C(=CC6=[n+]2[Co+3]3(n5c(c4)C=C(C5=C6)C)n78)C)C)CCC(=O)O)C | | InChi: | InChI=1S/C30H30N4O4.Co/c1-15-9-20-12-25-17(3)21(5-7-29(35)36)27(33-25)14-28-22(6-8-30(37)38)18(4)26(34-28)13-24-16(2)10-19(32-24)11-23(15)31-20 | | Definition date: | 2002-02-26 | | Last modified: | 2024-09-27 | | Identifier: | [3,3'-(3,7,12,17-tetramethylporphyrin-2,18-diyl-kappa~4~N~21~,N~22~,N~23~,N~24~)dipropanoato(2-)]cobalt(5+) |
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 | | DFF | | Name: | 4-benzoyl-D-phenylalanine | | Formula: | C16 H15 N O3 | | SMILES: | O=C(O)C(N)Cc1ccc(cc1)C(=O)c2ccccc2 | | InChi: | InChI=1S/C16H15NO3/c17-14(16(19)20)10-11-6-8-13(9-7-11)15(18)12-4-2-1-3-5-12/h1-9,14H,10,17H2,(H,19,20)/t14-/m1/s1 | | Definition date: | 2013-12-24 | | Last modified: | 2024-09-27 | | Release date: | 2014-05-21 | | Identifier: | 4-benzoyl-D-phenylalanine |
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 | | DFK | | Name: | D-PHENYLALANYL-N-[(1S)-4-{[(Z)-AMINO(IMINO)METHYL]AMINO}-1-(CHLOROACETYL)BUTYL]-L-PROLINAMIDE | | Formula: | C21 H34 N6 O3 | | SMILES: | O=C(NC(CCCNC(=[N@H])N)C(O)C)C2N(C(=O)C(N)Cc1ccccc1)CCC2 | | InChi: | InChI=1S/C21H34N6O3/c1-14(28)17(9-5-11-25-21(23)24)26-19(29)18-10-6-12-27(18)20(30)16(22)13-15-7-3-2-4-8-15/h2-4,7-8,14,16-18,28H,5-6,9-13,22H2,1H3,(H,26,29)(H4,23,24,25)/t14?,16-,17+,18+/m1/s1 | | Synonyms: | D-PHENYLALANYL-PROLYL-ARGINYL-CHLOROMETHANE | | Definition date: | 2006-02-03 | | Last modified: | 2024-09-27 | | Identifier: | D-phenylalanyl-N-{(1S)-4-carbamimidamido-1-[(1R)-1-hydroxyethyl]butyl}-L-prolinamide |
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 | | DFR | | Name: | 3-deoxy-3-methyl-beta-D-fructofuranose | | Formula: | C7 H14 O5 | | SMILES: | OCC1(O)OC(C(O)C1C)CO | | InChi: | InChI=1S/C7H14O5/c1-4-6(10)5(2-8)12-7(4,11)3-9/h4-6,8-11H,2-3H2,1H3/t4-,5+,6-,7+/m0/s1 | | Synonyms: | 3-DEOXY-3-METHYL-D-FRUCTOSE | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 3-deoxy-3-methyl-beta-D-fructofuranose |
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 | | DFX | | Name: | 1,5-anhydro-2-deoxy-2-fluoro-D-xylitol | | Formula: | C5 H9 F O3 | | SMILES: | FC1COCC(O)C1O | | InChi: | InChI=1S/C5H9FO3/c6-3-1-9-2-4(7)5(3)8/h3-5,7-8H,1-2H2/t3-,4+,5+/m0/s1 | | Synonyms: | 1,2-DEOXY-2-FLUORO-XYLOPYRANOSE | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 1,5-anhydro-2-deoxy-2-fluoro-D-xylitol |
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 | | DHV | | Name: | 3-hydroxy-D-valine | | Formula: | C5 H11 N O3 | | SMILES: | O=C(O)C(N)C(O)(C)C | | InChi: | InChI=1S/C5H11NO3/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m0/s1 | | Synonyms: | D-beta-hydroxyvaline | | Definition date: | 2008-06-03 | | Last modified: | 2024-09-27 | | Identifier: | 3-hydroxy-D-valine |
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 | | DI2 | | Name: | AC-(D)PHE-PRO-BOROLYS-OH | | Formula: | C21 H33 B N4 O5 | | SMILES: | O=C(NC(B(O)O)CCCCN)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2 | | InChi: | InChI=1S/C21H33BN4O5/c1-15(27)24-17(14-16-8-3-2-4-9-16)21(29)26-13-7-10-18(26)20(28)25-19(22(30)31)11-5-6-12-23/h2-4,8-9,17-19,30-31H,5-7,10-14,23H2,1H3,(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | N-acetyl-D-phenylalanyl-N-[(1R)-5-amino-1-(dihydroxyboranyl)pentyl]-L-prolinamide |
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 | | DI3 | | Name: | AC-(D)PHE-PRO-BORO-N-BUTYL-AMIDINO-GLYCINE-OH | | Formula: | C22 H34 B N5 O5 | | SMILES: | O=C(NC(B(O)O)CCCCC(=[N@H])N)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2 | | InChi: | InChI=1S/C22H34BN5O5/c1-15(29)26-17(14-16-8-3-2-4-9-16)22(31)28-13-7-10-18(28)21(30)27-19(23(32)33)11-5-6-12-20(24)25/h2-4,8-9,17-19,32-33H,5-7,10-14H2,1H3,(H3,24,25)(H,26,29)(H,27,30)/t17-,18+,19+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | N-acetyl-D-phenylalanyl-N-[(1R,6Z)-6-amino-1-(dihydroxyboranyl)-6-iminohexyl]-L-prolinamide |
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 | | DI4 | | Name: | AC-(D)PHE-PRO-BOROHOMOLYS-OH | | Formula: | C22 H35 B N4 O5 | | SMILES: | O=C(NC(B(O)O)CCCCCN)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2 | | InChi: | InChI=1S/C22H35BN4O5/c1-16(28)25-18(15-17-9-4-2-5-10-17)22(30)27-14-8-11-19(27)21(29)26-20(23(31)32)12-6-3-7-13-24/h2,4-5,9-10,18-20,31-32H,3,6-8,11-15,24H2,1H3,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | N-acetyl-D-phenylalanyl-N-[(1R)-6-amino-1-(dihydroxyboranyl)hexyl]-L-prolinamide |
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 | | DI5 | | Name: | AC-(D)PHE-PRO-BOROHOMOORNITHINE-OH | | Formula: | C20 H31 B N4 O5 | | SMILES: | O=C(NC(B(O)O)CCCN)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2 | | InChi: | InChI=1S/C20H31BN4O5/c1-14(26)23-16(13-15-7-3-2-4-8-15)20(28)25-12-6-9-17(25)19(27)24-18(21(29)30)10-5-11-22/h2-4,7-8,16-18,29-30H,5-6,9-13,22H2,1H3,(H,23,26)(H,24,27)/t16-,17+,18+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | N-acetyl-D-phenylalanyl-N-[(1R)-4-amino-1-(dihydroxyboranyl)butyl]-L-prolinamide |
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 | | DIV | | Name: | D-ISOVALINE | | Formula: | C5 H11 N O2 | | SMILES: | O=C(O)C(N)(C)CC | | InChi: | InChI=1S/C5H11NO2/c1-3-5(2,6)4(7)8/h3,6H2,1-2H3,(H,7,8)/t5-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | D-isovaline |
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 | | DLE | | Name: | D-LEUCINE | | Formula: | C6 H13 N O2 | | SMILES: | O=C(O)C(N)CC(C)C | | InChi: | InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | D-leucine |
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 | | DMT | | Name: | 3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACID | | Formula: | C11 H21 N O3 | | SMILES: | O=C(O)C(NC)C(O)C(C/C=C/C)(C)C | | InChi: | InChI=1S/C11H21NO3/c1-5-6-7-11(2,3)9(13)8(12-4)10(14)15/h5-6,8-9,12-13H,7H2,1-4H3,(H,14,15)/b6-5+/t8-,9-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 4-[(2E)-but-2-en-1-yl]-2,4,5-trideoxy-4-methyl-2-(methylamino)-D-arabinonic acid |
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 | | DN1 | | Name: | 3-({(2S)-2-[({(1R)-1-[({(1R)-1-[(R)-CARBOXY(HYDROXY)METHYL]-3,3-DIFLUOROPROPYL}AMINO)CARBONYL]-3-METHYLBUTYL}AMINO)CARB
ONYL]-2,3-DIHYDRO-1H-INDOL-2-YL}METHYL)THIOPHENE-2-CARBOXYLIC ACID | | Formula: | C26 H31 F2 N3 O7 S | | SMILES: | O=C(O)C(O)C(NC(=O)C(NC(=O)C2(Nc1ccccc1C2)Cc3c(scc3)C(=O)O)CC(C)C)CC(F)F | | InChi: | InChI=1S/C26H31F2N3O7S/c1-13(2)9-18(22(33)29-17(10-19(27)28)20(32)23(34)35)30-25(38)26(11-14-5-3-4-6-16(14)31-26)12-15-7-8-39-21(15)24(36)37/h3-8,13,17-20,31-32H,9-12H2,1-2H3,(H,29,33)(H,30,38)(H,34,35)(H,36,37)/t17-,18-,20-,26+/m1/s1 | | Synonyms: | PEPTIDOMIMETIC INHIBITOR | | Definition date: | 2004-07-14 | | Last modified: | 2024-09-27 | | Identifier: | 3-{[N-({(2S)-2-[(2-carboxythiophen-3-yl)methyl]-2,3-dihydro-1H-indol-2-yl}carbonyl)-D-leucyl]amino}-3,4,5-trideoxy-5,5-difluoro-D-erythro-pentonic acid |
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