 | | T3 | | 表記: | 3,5,3'TRIIODOTHYRONINE | | 組成式: | C15 H12 I3 N O4 | | SMILES: | O=C(O)C(N)Cc2cc(I)c(Oc1cc(I)c(O)cc1)c(I)c2 | | InChi: | InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1 | | 別名: | T3 | | 定義日: | 1999-07-12 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-L-tyrosine |
|
 | | QPA | | 表記: | S-[(1S)-1-carboxy-1-(phosphonooxy)ethyl]-L-cysteine | | 組成式: | C6 H12 N O8 P S | | SMILES: | O=C(O)C(OP(=O)(O)O)(SCC(C(=O)O)N)C | | InChi: | InChI=1S/C6H12NO8PS/c1-6(5(10)11,15-16(12,13)14)17-2-3(7)4(8)9/h3H,2,7H2,1H3,(H,8,9)(H,10,11)(H2,12,13,14)/t3-,6-/m0/s1 | | 定義日: | 2011-07-12 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | S-[(1S)-1-carboxy-1-(phosphonooxy)ethyl]-L-cysteine |
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 | | QPH | | 表記: | N-formyl-L-phenylalanine | | 組成式: | C10 H11 N O3 | | SMILES: | O=C(O)C(NC=O)Cc1ccccc1 | | InChi: | InChI=1S/C10H11NO3/c12-7-11-9(10(13)14)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,11,12)(H,13,14)/t9-/m0/s1 | | 定義日: | 2011-04-28 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | N-formyl-L-phenylalanine |
|
 | | R4K | | 表記: | (2S,3R)-2-azanyl-3-hydroxy-3-[(3S)-3-hydroxy-2-oxo-1H-indol-3-yl]propanoic acid | | 組成式: | C11 H12 N2 O5 | | SMILES: | O=C(O)C(N)C(O)C2(O)c1ccccc1NC2=O | | InChi: | InChI=1S/C11H12N2O5/c12-7(9(15)16)8(14)11(18)5-3-1-2-4-6(5)13-10(11)17/h1-4,7-8,14,18H,12H2,(H,13,17)(H,15,16)/t7-,8+,11-/m0/s1 | | 定義日: | 2011-03-25 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | (3R)-3-[(3S)-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl]-L-serine |
|
 | | 0FL | | 表記: | 3-amino-N-formyl-L-alanine | | 組成式: | C4 H8 N2 O3 | | SMILES: | O=CNC(C(=O)O)CN | | InChi: | InChI=1S/C4H8N2O3/c5-1-3(4(8)9)6-2-7/h2-3H,1,5H2,(H,6,7)(H,8,9)/t3-/m0/s1 | | 定義日: | 2010-09-24 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-amino-N-formyl-L-alanine |
|
 | | N00 | | 表記: | (2R)-2-(6-chloro-1-methyl-9H-carbazol-2-yl)propanoic acid | | 組成式: | C16 H14 Cl N O2 | | SMILES: | O=C(O)C(C)c1ccc2c3cc(Cl)ccc3[NH]c2c1C | | InChi: | InChI=1S/C16H14ClNO2/c1-8-11(9(2)16(19)20)4-5-12-13-7-10(17)3-6-14(13)18-15(8)12/h3-7,9,18H,1-2H3,(H,19,20)/t9-/m1/s1 | | 定義日: | 2023-08-16 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | (2R)-2-(6-chloro-1-methyl-9H-carbazol-2-yl)propanoic acid |
|
 | | N0A | | 表記: | 3-fluoro-L-phenylalanine | | 組成式: | C9 H10 F N O2 | | SMILES: | NC(Cc1cccc(c1)F)C(=O)O | | InChi: | InChI=1S/C9H10FNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1 | | 定義日: | 2019-04-26 | | 最終更新日: | 2023-11-03 | | 公開日: | 2020-04-29 | | 識別子（ID）: | 3-fluoro-L-phenylalanine |
|
 | | N0F | | 表記: | (3R)-3-(4-hydroxypiperidin-1-yl)-N-(4-methylpyridin-3-yl)-3-(thiophen-3-yl)propanamide | | 組成式: | C18 H23 N3 O2 S | | SMILES: | Cc1ccncc1NC(=O)CC(N1CCC(O)CC1)c1ccsc1 | | InChi: | InChI=1S/C18H23N3O2S/c1-13-2-6-19-11-16(13)20-18(23)10-17(14-5-9-24-12-14)21-7-3-15(22)4-8-21/h2,5-6,9,11-12,15,17,22H,3-4,7-8,10H2,1H3,(H,20,23)/t17-/m1/s1 | | 定義日: | 2023-08-16 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | (3R)-3-(4-hydroxypiperidin-1-yl)-N-(4-methylpyridin-3-yl)-3-(thiophen-3-yl)propanamide |
|
 | | QQF | | 表記: | 2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)-N~2~-(methoxyacetyl)-L-alaninamide | | 組成式: | C21 H19 Cl2 N3 O3 | | SMILES: | Clc1ccc(cc1Cl)C(C)(NC(=O)COC)C(=O)Nc1cncc2ccccc21 | | InChi: | InChI=1S/C21H19Cl2N3O3/c1-21(26-19(27)12-29-2,14-7-8-16(22)17(23)9-14)20(28)25-18-11-24-10-13-5-3-4-6-15(13)18/h3-11H,12H2,1-2H3,(H,25,28)(H,26,27)/t21-/m1/s1 | | 定義日: | 2023-08-18 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | 2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)-N~2~-(methoxyacetyl)-L-alaninamide |
|
 | | QQO | | 表記: | (2R)-N-{(2R)-2-(3,4-dichlorophenyl)-1-[(isoquinolin-4-yl)amino]-1-oxopropan-2-yl}-4-(propan-2-yl)morpholine-2-carboxamide | | 組成式: | C26 H28 Cl2 N4 O3 | | SMILES: | CC(C)N1CC(OCC1)C(=O)NC(C)(c1ccc(Cl)c(Cl)c1)C(=O)Nc1cncc2ccccc21 | | InChi: | InChI=1S/C26H28Cl2N4O3/c1-16(2)32-10-11-35-23(15-32)24(33)31-26(3,18-8-9-20(27)21(28)12-18)25(34)30-22-14-29-13-17-6-4-5-7-19(17)22/h4-9,12-14,16,23H,10-11,15H2,1-3H3,(H,30,34)(H,31,33)/t23-,26-/m1/s1 | | 定義日: | 2023-08-18 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | (2R)-N-{(2R)-2-(3,4-dichlorophenyl)-1-[(isoquinolin-4-yl)amino]-1-oxopropan-2-yl}-4-(propan-2-yl)morpholine-2-carboxamide |
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 | | SCH | | 表記: | S-METHYL-THIO-CYSTEINE | | 組成式: | C4 H9 N O2 S2 | | SMILES: | O=C(O)C(N)CSSC | | InChi: | InChI=1S/C4H9NO2S2/c1-8-9-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-(methyldisulfanyl)-L-alanine |
|
 | | SCS | | 表記: | 3-(ethyldisulfanyl)-L-alanine | | 組成式: | C5 H11 N O2 S2 | | SMILES: | O=C(O)C(N)CSSCC | | InChi: | InChI=1S/C5H11NO2S2/c1-2-9-10-3-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-(ethyldisulfanyl)-L-alanine |
|
 | | QR5 | | 表記: | (2R)-2-[2-(3-cyclopropyl-2-oxoimidazolidin-1-yl)acetamido]-2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)propanamide | | 組成式: | C26 H25 Cl2 N5 O3 | | SMILES: | Clc1ccc(cc1Cl)C(C)(NC(=O)CN1CCN(C2CC2)C1=O)C(=O)Nc1cncc2ccccc21 | | InChi: | InChI=1S/C26H25Cl2N5O3/c1-26(17-6-9-20(27)21(28)12-17,24(35)30-22-14-29-13-16-4-2-3-5-19(16)22)31-23(34)15-32-10-11-33(25(32)36)18-7-8-18/h2-6,9,12-14,18H,7-8,10-11,15H2,1H3,(H,30,35)(H,31,34)/t26-/m1/s1 | | 定義日: | 2023-08-21 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | (2R)-2-[2-(3-cyclopropyl-2-oxoimidazolidin-1-yl)acetamido]-2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)propanamide |
|
 | | SCY | | 表記: | S-ACETYL-CYSTEINE | | 組成式: | C5 H9 N O3 S | | SMILES: | O=C(O)C(N)CSC(=O)C | | InChi: | InChI=1S/C5H9NO3S/c1-3(7)10-2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9)/t4-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | S-acetyl-L-cysteine |
|
 | | QCO | | 表記: | N-[(1R)-2-{[2-(3-fluorophenyl)ethyl]amino}-2-oxo-1-(pyridin-3-yl)ethyl]-N-{4-[(propan-2-yl)oxy]phenyl}-1H-imidazole-4-carboxamide | | 組成式: | C28 H28 F N5 O3 | | SMILES: | O=C(N(C(c1cccnc1)C(=O)NCCc1cccc(F)c1)c1ccc(OC(C)C)cc1)c1c[NH]cn1 | | InChi: | InChI=1S/C28H28FN5O3/c1-19(2)37-24-10-8-23(9-11-24)34(28(36)25-17-31-18-33-25)26(21-6-4-13-30-16-21)27(35)32-14-12-20-5-3-7-22(29)15-20/h3-11,13,15-19,26H,12,14H2,1-2H3,(H,31,33)(H,32,35)/t26-/m1/s1 | | 定義日: | 2023-08-18 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | N-[(1R)-2-{[2-(3-fluorophenyl)ethyl]amino}-2-oxo-1-(pyridin-3-yl)ethyl]-N-{4-[(propan-2-yl)oxy]phenyl}-1H-imidazole-4-carboxamide |
|
 | | QCS | | 表記: | S-carbamoyl-L-cysteine | | 組成式: | C4 H8 N2 O3 S | | SMILES: | O=C(SCC(C(=O)O)N)N | | InChi: | InChI=1S/C4H8N2O3S/c5-2(3(7)8)1-10-4(6)9/h2H,1,5H2,(H2,6,9)(H,7,8)/t2-/m0/s1 | | 定義日: | 2013-10-21 | | 最終更新日: | 2023-11-03 | | 公開日: | 2013-12-18 | | 識別子（ID）: | S-carbamoyl-L-cysteine |
|
 | | QRS | | 表記: | (3S)-N-{(2R)-2-(3,4-dichlorophenyl)-1-[(isoquinolin-4-yl)amino]-1-oxopropan-2-yl}-1-methylpyrrolidine-3-carboxamide | | 組成式: | C24 H24 Cl2 N4 O2 | | SMILES: | O=C(NC(C)(c1ccc(Cl)c(Cl)c1)C(=O)Nc1cncc2ccccc21)C1CCN(C)C1 | | InChi: | InChI=1S/C24H24Cl2N4O2/c1-24(17-7-8-19(25)20(26)11-17,29-22(31)16-9-10-30(2)14-16)23(32)28-21-13-27-12-15-5-3-4-6-18(15)21/h3-8,11-13,16H,9-10,14H2,1-2H3,(H,28,32)(H,29,31)/t16-,24+/m0/s1 | | 定義日: | 2023-08-21 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | (3S)-N-{(2R)-2-(3,4-dichlorophenyl)-1-[(isoquinolin-4-yl)amino]-1-oxopropan-2-yl}-1-methylpyrrolidine-3-carboxamide |
|
 | | R7F | | 表記: | (4R)-6-chloro-N-[6-(2-hydroxypropan-2-yl)isoquinolin-4-yl]-1,2,3,4-tetrahydroquinoline-4-carboxamide | | 組成式: | C22 H22 Cl N3 O2 | | SMILES: | CC(C)(O)c1cc2c(cc1)cncc2NC(=O)C1CCNc2ccc(Cl)cc21 | | InChi: | InChI=1S/C22H22ClN3O2/c1-22(2,28)14-4-3-13-11-24-12-20(17(13)9-14)26-21(27)16-7-8-25-19-6-5-15(23)10-18(16)19/h3-6,9-12,16,25,28H,7-8H2,1-2H3,(H,26,27)/t16-/m1/s1 | | 定義日: | 2023-08-21 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | (4R)-6-chloro-N-[6-(2-hydroxypropan-2-yl)isoquinolin-4-yl]-1,2,3,4-tetrahydroquinoline-4-carboxamide |
|
 | | N2C | | 表記: | N,S-DIMETHYLCYSTEINE | | 組成式: | C5 H11 N O2 S | | SMILES: | O=C(O)C(NC)CSC | | InChi: | InChI=1S/C5H11NO2S/c1-6-4(3-9-2)5(7)8/h4,6H,3H2,1-2H3,(H,7,8)/t4-/m0/s1 | | 定義日: | 2004-11-02 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | N,S-dimethyl-L-cysteine |
|
 | | SE7 | | 表記: | 2-AMINO-3-SELENINO-PROPIONIC ACID | | 組成式: | C3 H7 N O4 Se | | SMILES: | O=C(O)C(N)C[Se](=O)O | | InChi: | InChI=1S/C3H7NO4Se/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)(H,7,8)/t2-/m0/s1 | | 定義日: | 2013-12-19 | | 最終更新日: | 2023-11-03 | | 公開日: | 2013-12-25 | | 識別子（ID）: | 3-selenino-L-alanine |
|
 | | SEC | | 表記: | SELENOCYSTEINE | | 組成式: | C3 H7 N O2 Se | | SMILES: | O=C(O)C(N)C[SeH] | | InChi: | InChI=1S/C3H7NO2Se/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-selanyl-L-alanine |
|
 | | SEL | | 表記: | 2-AMINO-1,3-PROPANEDIOL | | 組成式: | C3 H9 N O2 | | SMILES: | OCC(N)CO | | InChi: | InChI=1S/C3H9NO2/c4-3(1-5)2-6/h3,5-6H,1-2,4H2 | | 別名: | SERINOL | | 定義日: | 1999-10-14 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 2-aminopropane-1,3-diol |
|
 | | SEM | | 表記: | O-benzyl-L-serine | | 組成式: | C10 H13 N O3 | | SMILES: | O=C(O)C(N)COCc1ccccc1 | | InChi: | InChI=1S/C10H13NO3/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1 | | 別名: | (2S)-2-azanyl-3-phenylmethoxy-propanoic acid | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | O-benzyl-L-serine |
|
 | | SEP | | 表記: | PHOSPHOSERINE | | 組成式: | C3 H8 N O6 P | | SMILES: | O=P(O)(O)OCC(C(=O)O)N | | InChi: | InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1 | | 別名: | PHOSPHONOSERINE | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | O-phosphono-L-serine |
|
 | | SER | | 表記: | SERINE | | 組成式: | C3 H7 N O3 | | SMILES: | O=C(O)C(N)CO | | InChi: | InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | L-serine |
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