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AZ0

AZ0
Name:	ethyl (5S,8S,14S)-14-hydroxy-5,8,11-tris(2-methylpropyl)-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadecan-15-oate
Formula:	C30 H48 N4 O8
SMILES:	O=C(OCC)C(O)CC(=O)N(NC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C)CC(C)C
InChi:	InChI=1S/C30H48N4O8/c1-8-41-29(39)25(35)16-26(36)34(17-21(6)7)33-28(38)24(15-20(4)5)31-27(37)23(14-19(2)3)32-30(40)42-18-22-12-10-9-11-13-22/h9-13,19-21,23-25,35H,8,14-18H2,1-7H3,(H,31,37)(H,32,40)(H,33,38)/t23-,24-,25-/m0/s1
Definition date:	2009-03-18
Last modified:	2011-06-04
Identifier:	ethyl (5S,8S,14S)-14-hydroxy-5,8,11-tris(2-methylpropyl)-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadecan-15-oate

AZD

AZD
Name:	3'-AZIDO-3'-DEOXYTHYMIDINE-5'-DIPHOSPHATE
Formula:	C10 H15 N5 O10 P2
SMILES:	O=P(O)(O)OP(=O)(O)OCC2OC(N1C(=O)NC(=O)C(=C1)C)CC2/N=[N+]=[N-]
InChi:	InChI=1S/C10H15N5O10P2/c1-5-3-15(10(17)12-9(5)16)8-2-6(13-14-11)7(24-8)4-23-27(21,22)25-26(18,19)20/h3,6-8H,2,4H2,1H3,(H,21,22)(H,12,16,17)(H2,18,19,20)/t6-,7+,8+/m0/s1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	3'-azido-3'-deoxythymidine 5'-(trihydrogen diphosphate)

AZN

AZN
Name:	ALIZARIN RED
Formula:	C14 H8 O7 S
SMILES:	O=S(=O)(O)c3cc2C(=O)c1ccccc1C(=O)c2c(O)c3O
InChi:	InChI=1S/C14H8O7S/c15-11-6-3-1-2-4-7(6)12(16)10-8(11)5-9(22(19,20)21)13(17)14(10)18/h1-5,17-18H,(H,19,20,21)
Definition date:	2003-01-21
Last modified:	2011-06-04
Identifier:	3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid

AZT

AZT
Name:	3'-AZIDO-3'-DEOXYTHYMIDINE-5'-TRIPHOSPHATE
Formula:	C10 H16 N5 O13 P3
SMILES:	O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC2OC(N1C(=O)NC(=O)C(=C1)C)CC2N=[N+]=[N-]
InChi:	InChI=1S/C10H16N5O13P3/c1-5-3-15(10(17)12-9(5)16)8-2-6(13-14-11)7(26-8)4-25-30(21,22)28-31(23,24)27-29(18,19)20/h3,6-8H,2,4H2,1H3,(H,21,22)(H,23,24)(H,12,16,17)(H2,18,19,20)/t6-,7+,8+/m0/s1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	3'-azido-3'-deoxythymidine 5'-(tetrahydrogen triphosphate)

AZY

AZY
Name:	3-AZIDO-L-TYROSINE
Formula:	C9 H10 N4 O3
SMILES:	O=C(O)C(N)Cc1ccc(O)c(N=[N+]=[N-])c1
InChi:	InChI=1S/C9H10N4O3/c10-6(9(15)16)3-5-1-2-8(14)7(4-5)12-13-11/h1-2,4,6,14H,3,10H2,(H,15,16)/t6-/m0/s1
Definition date:	2007-07-11
Last modified:	2011-06-04
Identifier:	3-azido-L-tyrosine

B10

B10
Name:	N-{5-tert-butyl-2-methoxy-3-[({4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl}carbamoyl)amino]phenyl}methanesulfonamide
Formula:	C33 H39 N5 O5 S
SMILES:	O=S(=O)(Nc1cc(cc(c1OC)NC(=O)Nc3c2c(cccc2)c(cc3)c4ccc(nc4)CN5CCOCC5)C(C)(C)C)C
InChi:	InChI=1S/C33H39N5O5S/c1-33(2,3)23-18-29(31(42-4)30(19-23)37-44(5,40)41)36-32(39)35-28-13-12-25(26-8-6-7-9-27(26)28)22-10-11-24(34-20-22)21-38-14-16-43-17-15-38/h6-13,18-20,37H,14-17,21H2,1-5H3,(H2,35,36,39)
Definition date:	2009-03-20
Last modified:	2011-06-04
Identifier:	N-{5-tert-butyl-2-methoxy-3-[({4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl}carbamoyl)amino]phenyl}methanesulfonamide

B13

B13
Name:	5-HYDROXYBENZIMIDAZOLYLCOB(III)AMIDE
Formula:	C60 H88 Co N13 O15 P
SMILES:	C[CH](CNC(=O)CC[C]1(C)[CH](CC(N)=O)[CH]2N3[CH]1C(=C4[CH](CCC(N)=O)C(C)(C)[CH]5C=C6[CH](CCC(N)=O)[C](C)(CC(N)=O)C7=C(C)[CH]8[CH](CCC(N)=O)[C](C)(CC(N)=O)[C]2(C)N8[Co]3(N45)N67)C)O[P](O)(=O)O[CH]9[CH](O)[CH](O[CH]9CO)n%10cnc%11cc(O)ccc%10%11
InChi:	InChI=1S/C60H88N13O15P.Co/c1-28(87-89(84,85)88-51-39(26-74)86-55(50(51)83)73-27-68-37-20-31(75)10-14-38(37)73)25-67-47(82)18-19-57(6)35(21-44(64)79)54-60(9)59(8,24-46(66)81)34(13-17-43(63)78)49(72-60)30(3)53-58(7,23-45(65)80)32(11-15-41(61)76)36(69-53)22-40-56(4,5)33(12-16-42(62)77)48(70-40)29(2)52(57)71-54
Definition date:	2006-08-24
Last modified:	2011-06-04

B15

B15
Name:	[2,2'-({4-[({2-[4-(AMINOSULFONYL)PHENYL]ETHYL}AMINO)CARBONYL]BENZYL}IMINO)DIACETATO(2-)-KAPPAO]COPPER
Formula:	C20 H21 Cu N3 O7 S
SMILES:	O=C1O[Cu]OC(=O)CN(C1)Cc3ccc(C(=O)NCCc2ccc(cc2)S(=O)(=O)N)cc3
InChi:	InChI=1S/C20H23N3O7S.Cu/c21-31(29,30)17-7-3-14(4-8-17)9-10-22-20(28)16-5-1-15(2-6-16)11-23(12-18(24)25)13-19(26)27
Definition date:	2006-02-02
Last modified:	2011-06-04
Identifier:	{2,2'-[(4-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}benzyl)imino]diacetato(2-)-kappaO}copper

B1T

B1T
Name:	2,2'-sulfanediylbis(4,6-dichlorophenol)
Formula:	C12 H6 Cl4 O2 S
SMILES:	Clc2cc(Cl)cc(Sc1cc(Cl)cc(Cl)c1O)c2O
InChi:	InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
Definition date:	2008-11-04
Last modified:	2011-06-04
Identifier:	2,2'-sulfanediylbis(4,6-dichlorophenol)

B22

B22
Name:	[2,2'-{[2-({3-[({2-[4-(AMINOSULFONYL)PHENYL]ETHYL}AMINO)CARBONYL]PHENYL}AMINO)-2-OXOETHYL]IMINO}DIACETATO(2-)-KAPPAO]COPPER
Formula:	C21 H22 Cu N4 O8 S
SMILES:	O=C1O[Cu]OC(=O)CN(C1)CC(=O)Nc3cc(C(=O)NCCc2ccc(cc2)S(=O)(=O)N)ccc3
InChi:	InChI=1S/C21H24N4O8S.Cu/c22-34(32,33)17-6-4-14(5-7-17)8-9-23-21(31)15-2-1-3-16(10-15)24-18(26)11-25(12-19(27)28)13-20(29)30
Definition date:	2006-03-27
Last modified:	2011-06-04
Identifier:	[2,2'-({2-oxo-2-[(3-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)amino]ethyl}imino)diacetato(2-)-kappaO]copper

B23

B23
Name:	5-(2-NITROPHENYL)-2-FUROIC ACID
Formula:	C11 H7 N O5
SMILES:	O=C(O)c2oc(c1c([N+]([O-])=O)cccc1)cc2
InChi:	InChI=1S/C11H7NO5/c13-11(14)10-6-5-9(17-10)7-3-1-2-4-8(7)12(15)16/h1-6H,(H,13,14)
Definition date:	2007-06-26
Last modified:	2011-06-04
Identifier:	5-(2-nitrophenyl)furan-2-carboxylic acid

B2
Name:	(2R)-5-FLUORO-2-(2-THIENYL)-1,2-DIHYDROQUINAZOLIN-4-AMINE
Formula:	C12 H10 F N3 S
SMILES:	Fc3c1c(NC(N=C1N)c2sccc2)ccc3
InChi:	InChI=1S/C12H10FN3S/c13-7-3-1-4-8-10(7)11(14)16-12(15-8)9-5-2-6-17-9/h1-6,12,15H,(H2,14,16)/t12-/m1/s1
Definition date:	2006-01-25
Last modified:	2011-06-04
Identifier:	(2R)-5-fluoro-2-thiophen-2-yl-1,2-dihydroquinazolin-4-amine

B2Y

B2Y
Name:	1-biphenyl-2-ylmethanamine
Formula:	C13 H13 N
SMILES:	c2(c1ccccc1CN)ccccc2
InChi:	InChI=1S/C13H13N/c14-10-12-8-4-5-9-13(12)11-6-2-1-3-7-11/h1-9H,10,14H2
Definition date:	2008-02-27
Last modified:	2011-06-04
Identifier:	1-biphenyl-2-ylmethanamine

B30

B30
Name:	{2,2'-[(2-{[4-(AMINOSULFONYL)BENZOYL]AMINO}ETHYL)IMINO]DIACETATO(2-)-KAPPAO}COPPER
Formula:	C13 H15 Cu N3 O7 S
SMILES:	O=C1O[Cu]OC(=O)CN(C1)CCNC(=O)c2ccc(cc2)S(=O)(=O)N
InChi:	InChI=1S/C13H17N3O7S.Cu/c14-24(22,23)10-3-1-9(2-4-10)13(21)15-5-6-16(7-11(17)18)8-12(19)20
Definition date:	2006-03-27
Last modified:	2011-06-04
Identifier:	{2,2'-[(2-{[(4-sulfamoylphenyl)carbonyl]amino}ethyl)imino]diacetato(2-)-kappaO}copper

B34

B34
Name:	(5S)-1-benzyl-3-(1,1-dioxido-1,2-benzisothiazol-3-yl)-4-hydroxy-5-(1-methylethyl)-1,5-dihydro-2H-pyrrol-2-one
Formula:	C21 H20 N2 O4 S
SMILES:	O=C4N(Cc1ccccc1)C(C(O)=C4C3=NS(=O)(=O)c2ccccc23)C(C)C
InChi:	InChI=1S/C21H20N2O4S/c1-13(2)19-20(24)17(21(25)23(19)12-14-8-4-3-5-9-14)18-15-10-6-7-11-16(15)28(26,27)22-18/h3-11,13,19,24H,12H2,1-2H3/t19-/m0/s1
Definition date:	2008-05-11
Last modified:	2011-06-04
Identifier:	(5S)-1-benzyl-3-(1,1-dioxido-1,2-benzisothiazol-3-yl)-4-hydroxy-5-(1-methylethyl)-1,5-dihydro-2H-pyrrol-2-one

F34

F34
Name:	N-[(3S,4R,5R,6R)-4,5,6-trihydroxyazepan-3-yl]acetamide
Formula:	C8 H16 N2 O4
SMILES:	O=C(NC1CNCC(O)C(O)C1O)C
InChi:	InChI=1S/C8H16N2O4/c1-4(11)10-5-2-9-3-6(12)8(14)7(5)13/h5-9,12-14H,2-3H2,1H3,(H,10,11)/t5-,6+,7+,8+/m0/s1
Definition date:	2008-12-17
Last modified:	2011-06-04
Identifier:	N-[(3S,4R,5R,6R)-4,5,6-trihydroxyazepan-3-yl]acetamide

F3F

F3F
Name:	S-[5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL] 5-(PHENYLETHYNYL)FURAN-2-CARBOTHIOATE
Formula:	C16 H8 F3 N3 O2 S
SMILES:	FC(F)(F)c3nnc(SC(=O)c2oc(C#Cc1ccccc1)cc2)n3
InChi:	InChI=1S/C16H8F3N3O2S/c17-16(18,19)14-20-15(22-21-14)25-13(23)12-9-8-11(24-12)7-6-10-4-2-1-3-5-10/h1-5,8-9H,(H,20,21,22)
Definition date:	2006-05-16
Last modified:	2011-06-04
Identifier:	S-[5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl] 5-(phenylethynyl)furan-2-carbothioate

F4C

F4C
Name:	2-(4-fluorophenyl)-3-oxo-6-pyridin-4-yl-N-[2-(trifluoromethyl)benzyl]-2,3-dihydropyridazine-4-carboxamide
Formula:	C24 H16 F4 N4 O2
SMILES:	FC(F)(F)c1ccccc1CNC(=O)C=2C(=O)N(N=C(C=2)c3ccncc3)c4ccc(F)cc4
InChi:	InChI=1S/C24H16F4N4O2/c25-17-5-7-18(8-6-17)32-23(34)19(13-21(31-32)15-9-11-29-12-10-15)22(33)30-14-16-3-1-2-4-20(16)24(26,27)28/h1-13H,14H2,(H,30,33)
Definition date:	2009-10-05
Last modified:	2011-06-04
Identifier:	2-(4-fluorophenyl)-3-oxo-6-(pyridin-4-yl)-N-[2-(trifluoromethyl)benzyl]-2,3-dihydropyridazine-4-carboxamide

F4P

F4P
Name:	1-[bis(4-fluorophenyl)methyl]-4-(1H-1,2,4-triazol-1-ylcarbonyl)piperazine
Formula:	C20 H19 F2 N5 O
SMILES:	O=C(N3CCN(C(c1ccc(F)cc1)c2ccc(F)cc2)CC3)n4ncnc4
InChi:	InChI=1S/C20H19F2N5O/c21-17-5-1-15(2-6-17)19(16-3-7-18(22)8-4-16)25-9-11-26(12-10-25)20(28)27-14-23-13-24-27/h1-8,13-14,19H,9-12H2
Definition date:	2009-09-28
Last modified:	2011-06-04
Identifier:	{4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}(1H-1,2,4-triazol-1-yl)methanone

F59

F59
Name:	N-[(biphenyl-4-ylcarbonyl)carbamoyl]-beta-D-glucopyranosylamine
Formula:	C20 H22 N2 O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c3ccc(c2ccccc2)cc3
InChi:	InChI=1S/C20H22N2O7/c23-10-14-15(24)16(25)17(26)19(29-14)22-20(28)21-18(27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,19,23-26H,10H2,(H2,21,22,27,28)/t14-,15-,16+,17-,19-/m1/s1
Definition date:	2008-02-12
Last modified:	2011-06-04
Identifier:	N-[(biphenyl-4-ylcarbonyl)carbamoyl]-beta-D-glucopyranosylamine

F68

F68
Name:	N-{[(4-methylphenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
Formula:	C15 H20 N2 O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ccc(cc2)C
InChi:	InChI=1S/C15H20N2O7/c1-7-2-4-8(5-3-7)13(22)16-15(23)17-14-12(21)11(20)10(19)9(6-18)24-14/h2-5,9-12,14,18-21H,6H2,1H3,(H2,16,17,22,23)/t9-,10-,11+,12-,14-/m1/s1
Definition date:	2008-02-12
Last modified:	2011-06-04
Identifier:	N-{[(4-methylphenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine

F69

F69
Name:	(2-thiophen-2-ylphenyl)methanol
Formula:	C11 H10 O S
SMILES:	OCc1ccccc1c2sccc2
InChi:	InChI=1S/C11H10OS/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-7,12H,8H2
Definition date:	2010-09-30
Last modified:	2011-06-04
Identifier:	[2-(thiophen-2-yl)phenyl]methanol

F6A

F6A
Name:	N-biphenyl-3-yl-2-(trifluoromethyl)benzamide
Formula:	C20 H14 F3 N O
SMILES:	FC(F)(F)c1ccccc1C(=O)Nc2cccc(c2)c3ccccc3
InChi:	InChI=1S/C20H14F3NO/c21-20(22,23)18-12-5-4-11-17(18)19(25)24-16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-13H,(H,24,25)
Definition date:	2010-01-06
Last modified:	2011-06-04
Identifier:	N-(3-phenylphenyl)-2-(trifluoromethyl)benzamide

F6Y

F6Y
Name:	3',6'-DIHYDROXY-3-OXO-3H-SPIRO[2-BENZOFURAN-1,9'-XANTHENE]-6-CARBOXYLIC ACID
Formula:	C21 H12 O7
SMILES:	O=C(O)c5cc1c(C(=O)OC13c4ccc(O)cc4Oc2cc(O)ccc23)cc5
InChi:	InChI=1S/C21H12O7/c22-11-2-5-14-17(8-11)27-18-9-12(23)3-6-15(18)21(14)16-7-10(19(24)25)1-4-13(16)20(26)28-21/h1-9,22-23H,(H,24,25)
Definition date:	2010-07-30
Last modified:	2011-06-04
Identifier:	3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxylic acid

F6Z

F6Z
Name:	3',6'-DIHYDROXY-3-OXO-3H-SPIRO[2-BENZOFURAN-1,9'-XANTHENE]-5-CARBOXYLIC ACID
Formula:	C21 H12 O7
SMILES:	O=C(O)c1cc2c(cc1)C4(OC2=O)c5ccc(O)cc5Oc3cc(O)ccc34
InChi:	InChI=1S/C21H12O7/c22-11-2-5-15-17(8-11)27-18-9-12(23)3-6-16(18)21(15)14-4-1-10(19(24)25)7-13(14)20(26)28-21/h1-9,22-23H,(H,24,25)
Definition date:	2010-07-30
Last modified:	2011-06-04
Identifier:	3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylic acid

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