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TCC
TCC
表記:2-(2,4-DICHLORO-PHENYLAMINO)-PHENOL
組成式:C12 H9 Cl2 N O
SMILES:Clc2cc(Cl)ccc2Nc1ccccc1O
InChi:InChI=1S/C12H9Cl2NO/c13-8-5-6-10(9(14)7-8)15-11-3-1-2-4-12(11)16/h1-7,15-16H
定義日:2003-01-17
最終更新日:2011-06-04
識別子（ID）:2-[(2,4-dichlorophenyl)amino]phenol
TCD
TCD
表記:3,5-DICHLORO-2-{4-[(3,5-DICHLOROPYRIDIN-2-YL)OXY]PHENOXY}PYRIDINE
組成式:C16 H8 Cl4 N2 O2
SMILES:Clc3cc(Cl)cnc3Oc2ccc(Oc1ncc(Cl)cc1Cl)cc2
InChi:InChI=1S/C16H8Cl4N2O2/c17-9-5-13(19)15(21-7-9)23-11-1-2-12(4-3-11)24-16-14(20)6-10(18)8-22-16/h1-8H
定義日:2004-10-27
最終更新日:2011-06-04
識別子（ID）:2,2'-[benzene-1,4-diylbis(oxy)]bis(3,5-dichloropyridine)
CEE
CEE
表記:(2-chloroethyl)benzene
組成式:C8 H9 Cl
SMILES:ClCCc1ccccc1
InChi:InChI=1S/C8H9Cl/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
定義日:2009-02-16
最終更新日:2011-06-04
識別子（ID）:(2-chloroethyl)benzene
TCL
TCL
表記:TRICLOSAN
組成式:C12 H7 Cl3 O2
SMILES:Clc2cc(Cl)ccc2Oc1ccc(Cl)cc1O
InChi:InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
定義日:1999-07-08
最終更新日:2011-06-04
識別子（ID）:5-chloro-2-(2,4-dichlorophenoxy)phenol
TCM
TCM
表記:THIOCAMPHOR
組成式:C10 H16 S
SMILES:S=C1CC2CCC1(C)C2(C)C
InChi:InChI=1S/C10H16S/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m1/s1
定義日:1999-07-08
最終更新日:2011-06-04
識別子（ID）:(1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-thione
TCN
TCN
表記:TETRACYANONICKELATE ION
組成式:C4 N4 Ni
SMILES:N#C[Ni-2](C#N)(C#N)C#N
InChi:InChI=1S/4CN.Ni/c4*1-2
定義日:1999-07-08
最終更新日:2011-06-04
識別子（ID）:tetrakis(cyano-kappaC)nickelate(2-)
CEJ
CEJ
表記:CYCLOPENTANE-1,3-DIONE
組成式:C5 H6 O2
SMILES:O=C1CC(=O)CC1
InChi:InChI=1S/C5H6O2/c6-4-1-2-5(7)3-4/h1-3H2
定義日:2006-03-26
最終更新日:2011-06-04
識別子（ID）:cyclopentane-1,3-dione
TCP
TCP
表記:5'-METHYLTHYMIDINE
組成式:C11 H16 N2 O5
SMILES:O=C1NC(=O)N(C=C1C)C2OC(C(O)C2)COC
InChi:InChI=1S/C11H16N2O5/c1-6-4-13(11(16)12-10(6)15)9-3-7(14)8(18-9)5-17-2/h4,7-9,14H,3,5H2,1-2H3,(H,12,15,16)/t7-,8+,9+/m0/s1
定義日:1999-07-08
最終更新日:2011-06-04
識別子（ID）:5'-O-methylthymidine
TCR
TCR
表記:CYCLOMETHYLTRYPTOPHAN
組成式:C12 H12 N2 O2
SMILES:O=C(O)C3NCc1c(c2c(n1)cccc2)C3
InChi:InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)/t10-/m0/s1
定義日:1999-07-08
最終更新日:2011-06-04
識別子（ID）:(3S)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid
TCT
TCT
表記:6-(4-CHLORO-2-HYDROXY-PHENOXY)-NAPHTHALEN-2-OL
組成式:C16 H11 Cl O3
SMILES:Clc3cc(O)c(Oc2cc1ccc(O)cc1cc2)cc3
InChi:InChI=1S/C16H11ClO3/c17-12-3-6-16(15(19)9-12)20-14-5-2-10-7-13(18)4-1-11(10)8-14/h1-9,18-19H
定義日:2003-01-17
最終更新日:2011-06-04
識別子（ID）:6-(4-chloro-2-hydroxyphenoxy)naphthalen-2-ol
CEQ
CEQ
表記:ETHYL-TRIMETHYL-SILANE
組成式:C5 H14 Si
SMILES:CC[Si](C)(C)C
InChi:InChI=1S/C5H14Si/c1-5-6(2,3)4/h5H2,1-4H3
定義日:2000-09-29
最終更新日:2011-06-04
識別子（ID）:ethyl(trimethyl)silane
TCY
TCY
表記:(2R,3aS,4aR,5aR,5bS)-2-(6-amino-9H-purin-9-yl)-3a-hydroxyhexahydrocyclopropa[4,5]cyclopenta[1,2-b]furan-5a(4H)-yl dihydrogen phosphate
組成式:C13 H16 N5 O6 P
SMILES:O=P(O)(O)OC54CC5CC3(O)C4OC(n1c2ncnc(N)c2nc1)C3
InChi:InChI=1S/C13H16N5O6P/c14-9-8-10(16-4-15-9)18(5-17-8)7-3-12(19)1-6-2-13(6,11(12)23-7)24-25(20,21)22/h4-7,11,19H,1-3H2,(H2,14,15,16)(H2,20,21,22)/t6-,7-,11+,12+,13-/m1/s1
定義日:2007-11-08
最終更新日:2011-06-04
識別子（ID）:(2R,3aS,4aR,5aR,5bS)-2-(6-amino-9H-purin-9-yl)-3a-hydroxyhexahydrocyclopropa[4,5]cyclopenta[1,2-b]furan-5a(4H)-yl dihydrogen phosphate
TCZ
TCZ
表記:1,3,5-TRICHLORO-BENZENE
組成式:C6 H3 Cl3
SMILES:Clc1cc(Cl)cc(Cl)c1
InChi:InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H
定義日:2002-01-09
最終更新日:2011-06-04
識別子（ID）:1,3,5-trichlorobenzene
TD3
TD3
表記:2-[hydroxy(4-hydroxybutyl)amino]-2-oxoethyl dihydrogen phosphate
組成式:C6 H14 N O7 P
SMILES:O=P(OCC(=O)N(O)CCCCO)(O)O
InChi:InChI=1S/C6H14NO7P/c8-4-2-1-3-7(10)6(9)5-14-15(11,12)13/h8,10H,1-5H2,(H2,11,12,13)
定義日:2010-06-08
最終更新日:2011-06-04
識別子（ID）:2-[hydroxy(4-hydroxybutyl)amino]-2-oxoethyl dihydrogen phosphate
TD4
TD4
表記:4-{hydroxy[(phosphonooxy)acetyl]amino}butyl dihydrogen phosphate
組成式:C6 H15 N O10 P2
SMILES:O=P(O)(O)OCC(=O)N(O)CCCCOP(=O)(O)O
InChi:InChI=1S/C6H15NO10P2/c8-6(5-17-19(13,14)15)7(9)3-1-2-4-16-18(10,11)12/h9H,1-5H2,(H2,10,11,12)(H2,13,14,15)
定義日:2010-06-08
最終更新日:2011-06-04
識別子（ID）:4-{hydroxy[(phosphonooxy)acetyl]amino}butyl dihydrogen phosphate
CEW
CEW
表記:(2R)-2-[(1R)-1-({[(2R)-2-amino-2,3-dihydro-1,3-thiazol-4-yl](methoxyimino)acetyl}amino)-2-oxoethyl]-5-methyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
組成式:C14 H19 N5 O5 S2
SMILES:O=CC(NC(=O)C(=NOC)C1=CSC(N)N1)C2SCC(=C(N2)C(=O)O)C
InChi:InChI=1S/C14H19N5O5S2/c1-6-4-25-12(18-9(6)13(22)23)7(3-20)16-11(21)10(19-24-2)8-5-26-14(15)17-8/h3,5,7,12,14,17-18H,4,15H2,1-2H3,(H,16,21)(H,22,23)/b19-10+/t7-,12-,14?/m1/s1
定義日:2009-06-17
最終更新日:2011-06-04
識別子（ID）:(2R)-2-[(1R)-1-{[(2E)-2-[(2R)-2-amino-2,3-dihydro-1,3-thiazol-4-yl]-2-(methoxyimino)acetyl]amino}-2-oxoethyl]-5-methyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
000
000
表記:methyl hydrogen carbonate
組成式:C2 H4 O3
SMILES:O=C(O)OC
InChi:InChI=1S/C2H4O3/c1-5-2(3)4/h1H3,(H,3,4)
定義日:2010-04-27
最終更新日:2011-06-04
識別子（ID）:methyl hydrogen carbonate
002
002
表記:N-[(2R)-2-BENZYL-4-(HYDROXYAMINO)-4-OXOBUTANOYL]-L-ISOLEUCYL-L-LEUCINE
組成式:C23 H35 N3 O6
SMILES:O=C(O)C(NC(=O)C(NC(=O)C(Cc1ccccc1)CC(=O)NO)C(C)CC)CC(C)C
InChi:InChI=1S/C23H35N3O6/c1-5-15(4)20(22(29)24-18(23(30)31)11-14(2)3)25-21(28)17(13-19(27)26-32)12-16-9-7-6-8-10-16/h6-10,14-15,17-18,20,32H,5,11-13H2,1-4H3,(H,24,29)(H,25,28)(H,26,27)(H,30,31)/t15-,17+,18-,20-/m0/s1
定義日:2006-02-02
最終更新日:2011-06-04
識別子（ID）:N-[(2R)-2-benzyl-4-(hydroxyamino)-4-oxobutanoyl]-L-isoleucyl-L-leucine
003
003
表記:5-METHYL-7-(2-METHYLPROPYL)-2-(NAPHTHALEN-1-YLMETHYL)-3-PYRIDIN-4-YL-2H-PYRAZOLO[3,4-D]PYRIMIDINE-4,6(5H,7H)-DIONE
組成式:C26 H25 N5 O2
SMILES:O=C3c2c(c1ccncc1)n(nc2N(C(=O)N3C)CC(C)C)Cc5c4ccccc4ccc5
InChi:InChI=1S/C26H25N5O2/c1-17(2)15-30-24-22(25(32)29(3)26(30)33)23(19-11-13-27-14-12-19)31(28-24)16-20-9-6-8-18-7-4-5-10-21(18)20/h4-14,17H,15-16H2,1-3H3
定義日:2007-02-06
最終更新日:2011-06-04
識別子（ID）:5-methyl-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-4-yl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
TDC
TDC
表記:5A,6-ANHYDROTETRACYCLINE
組成式:C22 H22 N2 O7
SMILES:O=C(N)C3=C(O)C(N(C)C)C4Cc2c(c1cccc(O)c1c(O)c2C(=O)C4(O)C3=O)C
InChi:InChI=1S/C22H22N2O7/c1-8-9-5-4-6-12(25)13(9)17(26)14-10(8)7-11-16(24(2)3)18(27)15(21(23)30)20(29)22(11,31)19(14)28/h4-6,11,16,25-27,31H,7H2,1-3H3,(H2,23,30)/t11-,16-,22-/m0/s1
定義日:2008-01-02
最終更新日:2011-06-04
識別子（ID）:(4S,4aS,12aS)-4-(dimethylamino)-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide
008
008
表記:(S)-2-[(R)-3-AMINO-4-(2-FLUORO-PHENYL)-BUTYRYL]-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID AMIDE
組成式:C20 H22 F N3 O2
SMILES:Fc1ccccc1CC(N)CC(=O)N3C(C(=O)N)Cc2c(cccc2)C3
InChi:InChI=1S/C20H22FN3O2/c21-17-8-4-3-6-14(17)9-16(22)11-19(25)24-12-15-7-2-1-5-13(15)10-18(24)20(23)26/h1-8,16,18H,9-12,22H2,(H2,23,26)/t16-,18+/m1/s1
定義日:2005-06-09
最終更新日:2011-06-04
識別子（ID）:(3S)-2-[(3R)-3-amino-4-(2-fluorophenyl)butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
009
009
表記:(4S)-1,4-dibenzyl-N-[(1S,2R)-1-benzyl-3-{[3-(dimethylamino)benzyl]amino}-2-hydroxypropyl]-2-oxoimidazolidine-4-carboxamide
組成式:C37 H43 N5 O3
SMILES:O=C4N(Cc1ccccc1)CC(C(=O)NC(Cc2ccccc2)C(O)CNCc3cccc(N(C)C)c3)(N4)Cc5ccccc5
InChi:InChI=1S/C37H43N5O3/c1-41(2)32-20-12-19-31(21-32)24-38-25-34(43)33(22-28-13-6-3-7-14-28)39-35(44)37(23-29-15-8-4-9-16-29)27-42(36(45)40-37)26-30-17-10-5-11-18-30/h3-21,33-34,38,43H,22-27H2,1-2H3,(H,39,44)(H,40,45)/t33-,34+,37-/m0/s1
定義日:2008-03-17
最終更新日:2011-06-04
識別子（ID）:(4S)-1,4-dibenzyl-N-[(1S,2R)-1-benzyl-3-{[3-(dimethylamino)benzyl]amino}-2-hydroxypropyl]-2-oxoimidazolidine-4-carboxamide
TDE
TDE
表記:(E)-(2R,3R,4S,5R)-3,4,5-TRIHYDROXY-2-METHOXY-8,8-DIMETHYL-NON-6-ENOIC ACID ((3S,6R)-6-HYDROXY-2-OXO-AZEPAN-3-YL)-AMIDE
組成式:C18 H32 N2 O7
SMILES:O=C1NCC(O)CCC1NC(=O)C(OC)C(O)C(O)C(O)/C=C/C(C)(C)C
InChi:InChI=1S/C18H32N2O7/c1-18(2,3)8-7-12(22)13(23)14(24)15(27-4)17(26)20-11-6-5-10(21)9-19-16(11)25/h7-8,10-15,21-24H,5-6,9H2,1-4H3,(H,19,25)(H,20,26)/b8-7+/t10-,11+,12-,13+,14-,15-/m1/s1
定義日:2003-09-19
最終更新日:2011-06-04
識別子（ID）:(2R,3R,4S,5R,6E)-3,4,5-trihydroxy-N-[(3S,6R)-6-hydroxy-2-oxoazepan-3-yl]-2-methoxy-8,8-dimethylnon-6-enamide (non-preferred name)
00A
00A
表記:5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosine
組成式:C17 H17 Cl N5 O8 P
SMILES:Clc1ccc(cc1)C(=O)OP(=O)(O)OCC4OC(n3cnc2c(ncnc23)N)C(O)C4O
InChi:InChI=1S/C17H17ClN5O8P/c18-9-3-1-8(2-4-9)17(26)31-32(27,28)29-5-10-12(24)13(25)16(30-10)23-7-22-11-14(19)20-6-21-15(11)23/h1-4,6-7,10,12-13,16,24-25H,5H2,(H,27,28)(H2,19,20,21)/t10-,12-,13-,16-/m1/s1
定義日:2008-04-28
最終更新日:2011-06-04
識別子（ID）:5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosine
00B
00B
表記:(4R)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
組成式:C6 H11 N O2 S
SMILES:O=C(O)C1NCSC1(C)C
InChi:InChI=1S/C6H11NO2S/c1-6(2)4(5(8)9)7-3-10-6/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m1/s1
定義日:2010-04-27
最終更新日:2011-06-04
識別子（ID）:(4R)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

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