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7EG
7EG
Name:2~3~-[(E)-(hydroxyimino)methyl][1~1~,2~1~:2~2~,3~1~-terphenyl]-1~4~,2~4~,3~4~-triol
Formula:C19 H15 N O4
SMILES:Oc1ccc(cc1)c2c(c(O)ccc2c3ccc(cc3)O)C=NO
InChi:InChI=1S/C19H15NO4/c21-14-5-1-12(2-6-14)16-9-10-18(23)17(11-20-24)19(16)13-3-7-15(22)8-4-13/h1-11,21-24H/b20-11+
Definition date:2016-10-14
Last modified:2017-01-13
Release date:2017-01-18
Identifier:2~3~-[(E)-(hydroxyimino)methyl][1~1~,2~1~:2~2~,3~1~-terphenyl]-1~4~,2~4~,3~4~-triol
7EH
7EH
Name:3-methyl-6-phenyl-3H-imidazo[4,5-b]pyridin-2-amine
Formula:C13 H12 N4
SMILES:Nc1nc2c(n1C)ncc(c2)c3ccccc3
InChi:InChI=1S/C13H12N4/c1-17-12-11(16-13(17)14)7-10(8-15-12)9-5-3-2-4-6-9/h2-8H,1H3,(H2,14,16)
Definition date:2016-10-14
Last modified:2017-01-13
Release date:2017-01-18
Identifier:3-methyl-6-phenyl-3H-imidazo[4,5-b]pyridin-2-amine
7EL
7EL
Name:2-chloro-4-[(E)-(hydroxyimino)methyl][1,1'-biphenyl]-3,4'-diol
Formula:C13 H10 Cl N O3
SMILES:Oc2ccc(c1c(c(O)c([C@H]=NO)cc1)Cl)cc2
InChi:InChI=1S/C13H10ClNO3/c14-12-11(8-1-4-10(16)5-2-8)6-3-9(7-15-18)13(12)17/h1-7,16-18H/b15-7+
Definition date:2016-10-14
Last modified:2017-01-13
Release date:2017-01-18
Identifier:2-chloro-4-[(E)-(hydroxyimino)methyl][1,1'-biphenyl]-3,4'-diol
7EM
7EM
Name:4,4',4''-(thiene-2,3,5-triyl)triphenol
Formula:C22 H16 O3 S
SMILES:Oc4ccc(c1sc(c(c1)c2ccc(O)cc2)c3ccc(cc3)O)cc4
InChi:InChI=1S/C22H16O3S/c23-17-7-1-14(2-8-17)20-13-21(15-3-9-18(24)10-4-15)26-22(20)16-5-11-19(25)12-6-16/h1-13,23-25H
Definition date:2016-10-14
Last modified:2017-01-13
Release date:2017-01-18
Identifier:4,4',4''-(thiene-2,3,5-triyl)triphenol
7EN
7EN
Name:(1S)-2,3-bis(2-chloro-4-hydroxyphenyl)-1H-1lambda~4~-thiophen-1-one
Formula:C16 H10 Cl2 O3 S
SMILES:Oc1ccc(c(c1)Cl)C=2S(C=CC=2c3c(Cl)cc(cc3)O)=O
InChi:InChI=1S/C16H10Cl2O3S/c17-14-7-9(19)1-3-11(14)12-5-6-22(21)16(12)13-4-2-10(20)8-15(13)18/h1-8,19-20H
Definition date:2016-10-15
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(1S)-2,3-bis(2-chloro-4-hydroxyphenyl)-1H-1lambda~4~-thiophen-1-one
7EO
7EO
Name:2,5-bis(2-chloro-4-hydroxyphenyl)-1H-1lambda~4~-thiophen-1-one
Formula:C16 H10 Cl2 O3 S
SMILES:Oc1cc(Cl)c(cc1)C2=CC=C(S2=O)c3c(Cl)cc(O)cc3
InChi:InChI=1S/C16H10Cl2O3S/c17-13-7-9(19)1-3-11(13)15-5-6-16(22(15)21)12-4-2-10(20)8-14(12)18/h1-8,19-20H
Definition date:2016-10-15
Last modified:2017-01-13
Release date:2017-01-18
Identifier:2,5-bis(2-chloro-4-hydroxyphenyl)-1H-1lambda~4~-thiophen-1-one
7EQ
7EQ
Name:2,5-bis(2-fluoro-4-hydroxyphenyl)-1H-1lambda~4~-thiophen-1-one
Formula:C16 H10 F2 O3 S
SMILES:Oc1ccc(c(c1)F)C=2S(C(=CC=2)c3c(F)cc(O)cc3)=O
InChi:InChI=1S/C16H10F2O3S/c17-13-7-9(19)1-3-11(13)15-5-6-16(22(15)21)12-4-2-10(20)8-14(12)18/h1-8,19-20H
Definition date:2016-10-15
Last modified:2017-01-13
Release date:2017-01-18
Identifier:2,5-bis(2-fluoro-4-hydroxyphenyl)-1H-1lambda~4~-thiophen-1-one
7ER
7ER
Name:3,4-bis(2-fluoro-4-hydroxyphenyl)-1H-1lambda~6~-thiophene-1,1-dione
Formula:C16 H10 F2 O4 S
SMILES:Fc1cc(O)ccc1C2=CS(=O)(=O)C=C2c3c(cc(O)cc3)F
InChi:InChI=1S/C16H10F2O4S/c17-15-5-9(19)1-3-11(15)13-7-23(21,22)8-14(13)12-4-2-10(20)6-16(12)18/h1-8,19-20H
Definition date:2016-10-15
Last modified:2017-01-13
Release date:2017-01-18
Identifier:3,4-bis(2-fluoro-4-hydroxyphenyl)-1H-1lambda~6~-thiophene-1,1-dione
7ES
7ES
Name:4,4'-(thiene-2,3-diyl)bis(3-fluorophenol)
Formula:C16 H10 F2 O2 S
SMILES:Oc1cc(F)c(cc1)c3c(c2ccc(cc2F)O)ccs3
InChi:InChI=1S/C16H10F2O2S/c17-14-7-9(19)1-3-11(14)12-5-6-21-16(12)13-4-2-10(20)8-15(13)18/h1-8,19-20H
Definition date:2016-10-15
Last modified:2017-01-13
Release date:2017-01-18
Identifier:4,4'-(thiene-2,3-diyl)bis(3-fluorophenol)
7ET
7ET
Name:3-fluorophenyl (1S,2R,4S)-5-(4-hydroxyphenyl)-6-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonate
Formula:C31 H32 F N O6 S
SMILES:c1(O)ccc(cc1)C4=C(c3ccc(OCCN2CCCCC2)cc3)C5OC4CC5S(=O)(Oc6cc(ccc6)F)=O
InChi:InChI=1S/C31H32FNO6S/c32-23-5-4-6-26(19-23)39-40(35,36)28-20-27-29(21-7-11-24(34)12-8-21)30(31(28)38-27)22-9-13-25(14-10-22)37-18-17-33-15-2-1-3-16-33/h4-14,19,27-28,31,34H,1-3,15-18,20H2/t27-,28+,31+/m0/s1
Definition date:2016-10-14
Last modified:2017-01-13
Release date:2017-01-18
Identifier:3-fluorophenyl (1S,2R,4S)-5-(4-hydroxyphenyl)-6-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonate
7EY
7EY
Name:3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid
Formula:C16 H14 N2 O2 S2
SMILES:Cc1ccc(cc1)c2csc3ncnc(SCCC(O)=O)c23
InChi:InChI=1S/C16H14N2O2S2/c1-10-2-4-11(5-3-10)12-8-22-16-14(12)15(17-9-18-16)21-7-6-13(19)20/h2-5,8-9H,6-7H2,1H3,(H,19,20)
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid
7FC
7FC
Name:4-[6,8-bis(chloranyl)-3-oxidanyl-4-oxidanylidene-chromen-2-yl]benzoic acid
Formula:C16 H8 Cl2 O5
SMILES:OC(=O)c1ccc(cc1)C2=C(O)C(=O)c3cc(Cl)cc(Cl)c3O2
InChi:InChI=1S/C16H8Cl2O5/c17-9-5-10-12(19)13(20)14(23-15(10)11(18)6-9)7-1-3-8(4-2-7)16(21)22/h1-6,20H,(H,21,22)
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:4-[6,8-bis(chloranyl)-3-oxidanyl-4-oxidanylidene-chromen-2-yl]benzoic acid
7FD
7FD
Name:ethyl 3-{4-[cyclohexylidene(4-hydroxyphenyl)methyl]phenyl}prop-2-enoate
Formula:C24 H26 O3
SMILES:Oc1ccc(cc1)C(=C2/CCCCC2)c3ccc([C@H]=CC(=O)OCC)cc3
InChi:InChI=1S/C24H26O3/c1-2-27-23(26)17-10-18-8-11-20(12-9-18)24(19-6-4-3-5-7-19)21-13-15-22(25)16-14-21/h8-17,25H,2-7H2,1H3
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:ethyl 3-{4-[cyclohexylidene(4-hydroxyphenyl)methyl]phenyl}prop-2-enoate
7FG
7FG
Name:ethyl 3-(4-{[(1s,5s)-bicyclo[3.3.1]nonan-9-ylidene](4-hydroxyphenyl)methyl}phenyl)prop-2-enoate
Formula:C27 H30 O3
SMILES:C1CCC2CCCC1C/2=C(/c3ccc(C=CC(OCC)=O)cc3)c4ccc(cc4)O
InChi:InChI=1S/C27H30O3/c1-2-30-25(29)18-11-19-9-12-22(13-10-19)27(23-14-16-24(28)17-15-23)26-20-5-3-6-21(26)8-4-7-20/h9-18,20-21,28H,2-8H2,1H3/t20-,21+
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:ethyl 3-(4-{[(1s,5s)-bicyclo[3.3.1]nonan-9-ylidene](4-hydroxyphenyl)methyl}phenyl)prop-2-enoate
7FJ
7FJ
Name:4,4'-[(1,3-dihydro-2H-inden-2-ylidene)methylene]diphenol
Formula:C22 H18 O2
SMILES:C1/C(Cc2c1cccc2)=C(/c3ccc(cc3)O)c4ccc(cc4)O
InChi:InChI=1S/C22H18O2/c23-20-9-5-15(6-10-20)22(16-7-11-21(24)12-8-16)19-13-17-3-1-2-4-18(17)14-19/h1-12,23-24H,13-14H2
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:4,4'-[(1,3-dihydro-2H-inden-2-ylidene)methylene]diphenol
7FL
7FL
Name:4,4'-(cycloheptylidenemethylene)diphenol
Formula:C20 H22 O2
SMILES:Oc1ccc(cc1)C(=C2CCCCCC2)c3ccc(O)cc3
InChi:InChI=1S/C20H22O2/c21-18-11-7-16(8-12-18)20(15-5-3-1-2-4-6-15)17-9-13-19(22)14-10-17/h7-14,21-22H,1-6H2
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:4,4'-(cycloheptylidenemethylene)diphenol
7FO
7FO
Name:4-iodophenyl (1S,2R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonate
Formula:C24 H19 I O6 S
SMILES:C2(=C(c1ccc(O)cc1)C3C(CC2O3)S(Oc4ccc(I)cc4)(=O)=O)c5ccc(cc5)O
InChi:InChI=1S/C24H19IO6S/c25-16-5-11-19(12-6-16)31-32(28,29)21-13-20-22(14-1-7-17(26)8-2-14)23(24(21)30-20)15-3-9-18(27)10-4-15/h1-12,20-21,24,26-27H,13H2/t20-,21+,24+/m0/s1
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:4-iodophenyl (1S,2R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonate
7FQ
7FQ
Name:(9beta,13alpha,14beta,16alpha,17alpha)-16-[(4-methoxyphenyl)methyl]estra-1,3,5(10)-triene-3,17-diol
Formula:C26 H32 O3
SMILES:c1cc2c(cc1O)CCC3C2CCC4(C3CC(C4O)Cc5ccc(cc5)OC)C
InChi:InChI=1S/C26H32O3/c1-26-12-11-22-21-10-6-19(27)14-17(21)5-9-23(22)24(26)15-18(25(26)28)13-16-3-7-20(29-2)8-4-16/h3-4,6-8,10,14,18,22-25,27-28H,5,9,11-13,15H2,1-2H3/t18-,22+,23+,24-,25-,26-/m0/s1
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(9beta,13alpha,14beta,16alpha,17alpha)-16-[(4-methoxyphenyl)methyl]estra-1,3,5(10)-triene-3,17-diol
7FR
7FR
Name:(9beta,13alpha,17Z)-17-{[4-(propan-2-yl)phenyl]imino}estra-1,3,5(10)-trien-3-ol
Formula:C27 H33 N O
SMILES:c1cc3c(cc1O)CCC4C2CCC(C2(C)CCC34)=Nc5ccc(cc5)C(C)C
InChi:InChI=1S/C27H33NO/c1-17(2)18-4-7-20(8-5-18)28-26-13-12-25-24-10-6-19-16-21(29)9-11-22(19)23(24)14-15-27(25,26)3/h4-5,7-9,11,16-17,23-25,29H,6,10,12-15H2,1-3H3/b28-26-/t23-,24-,25+,27+/m1/s1
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(9beta,13alpha,17Z)-17-{[4-(propan-2-yl)phenyl]imino}estra-1,3,5(10)-trien-3-ol
7FS
7FS
Name:(9beta,13alpha,17beta)-17-{[4-(propan-2-yl)phenyl]amino}estra-1(10),2,4-trien-3-ol
Formula:C27 H35 N O
SMILES:c1c(O)cc2c(c1)C3C(CC2)C4C(CC3)(C(CC4)Nc5ccc(cc5)C(C)C)C
InChi:InChI=1S/C27H35NO/c1-17(2)18-4-7-20(8-5-18)28-26-13-12-25-24-10-6-19-16-21(29)9-11-22(19)23(24)14-15-27(25,26)3/h4-5,7-9,11,16-17,23-26,28-29H,6,10,12-15H2,1-3H3/t23-,24-,25+,26+,27+/m1/s1
Definition date:2016-10-18
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(9beta,13alpha,17beta)-17-{[4-(propan-2-yl)phenyl]amino}estra-1(10),2,4-trien-3-ol
7FZ
7FZ
Name:(1S)-5-(4-hydroxy-3,5-dimethylphenyl)-2,3-dihydro-1H-inden-1-ol
Formula:C17 H18 O2
SMILES:Oc1c(cc(cc1C)c3cc2CCC(c2cc3)O)C
InChi:InChI=1S/C17H18O2/c1-10-7-14(8-11(2)17(10)19)12-3-5-15-13(9-12)4-6-16(15)18/h3,5,7-9,16,18-19H,4,6H2,1-2H3/t16-/m0/s1
Definition date:2016-10-19
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(1S)-5-(4-hydroxy-3,5-dimethylphenyl)-2,3-dihydro-1H-inden-1-ol
7G0
7G0
Name:(1S,3aS,5S,7aS)-5-(4-hydroxyphenyl)-7a-methyloctahydro-1H-inden-1-ol
Formula:C16 H22 O2
SMILES:c1c(ccc(c1)C2CC3C(CC2)(C(CC3)O)C)O
InChi:InChI=1S/C16H22O2/c1-16-9-8-12(10-13(16)4-7-15(16)18)11-2-5-14(17)6-3-11/h2-3,5-6,12-13,15,17-18H,4,7-10H2,1H3/t12-,13-,15-,16-/m0/s1
Definition date:2016-10-19
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(1S,3aS,5S,7aS)-5-(4-hydroxyphenyl)-7a-methyloctahydro-1H-inden-1-ol
7G1
7G1
Name:(1S,1'S,3a'S,7a'S)-7a'-methyl-1',2,2',3,3',3a',4',6',7',7a'-decahydro-1,5'-spirobi[indene]-1',5-diol
Formula:C18 H24 O2
SMILES:C1C4(CC2C(C1)(C)C(O)CC2)c3ccc(O)cc3CC4
InChi:InChI=1S/C18H24O2/c1-17-8-9-18(11-13(17)2-5-16(17)20)7-6-12-10-14(19)3-4-15(12)18/h3-4,10,13,16,19-20H,2,5-9,11H2,1H3/t13-,16-,17-,18-/m0/s1
Definition date:2016-10-19
Last modified:2017-01-13
Release date:2017-01-18
Identifier:(1S,1'S,3a'S,7a'S)-7a'-methyl-1',2,2',3,3',3a',4',6',7',7a'-decahydro-1,5'-spirobi[indene]-1',5-diol
7G2
7G2
Name:3-fluoro-3'-[(E)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol
Formula:C13 H10 F N O3
SMILES:Oc1c(cc(cc1)c2ccc(c(c2)C=NO)O)F
InChi:InChI=1S/C13H10FNO3/c14-11-6-9(2-4-13(11)17)8-1-3-12(16)10(5-8)7-15-18/h1-7,16-18H/b15-7+
Definition date:2016-10-19
Last modified:2017-01-13
Release date:2017-01-18
Identifier:3-fluoro-3'-[(E)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol
7G3
7G3
Name:3-[(Z)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol
Formula:C13 H11 N O3
SMILES:Oc2ccc(c1cc(C=N/O)c(O)cc1)cc2
InChi:InChI=1S/C13H11NO3/c15-12-4-1-9(2-5-12)10-3-6-13(16)11(7-10)8-14-17/h1-8,15-17H/b14-8-
Definition date:2016-10-19
Last modified:2017-01-13
Release date:2017-01-18
Identifier:3-[(Z)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol

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