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0N3
0N3
Name:3-({[(dihydroxyboranyl)methyl]sulfamoyl}methyl)benzoic acid
Formula:C9 H12 B N O6 S
SMILES:O=S(=O)(NCB(O)O)Cc1cccc(c1)C(=O)O
InChi:InChI=1S/C9H12BNO6S/c12-9(13)8-3-1-2-7(4-8)5-18(16,17)11-6-10(14)15/h1-4,11,14-15H,5-6H2,(H,12,13)
Definition date:2012-03-13
Last modified:2024-09-27
Release date:2012-09-21
Identifier:3-({[(dihydroxyboranyl)methyl]sulfamoyl}methyl)benzoic acid
0N4
0N4
Name:[({[4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid
Formula:C8 H10 B N5 O4 S
SMILES:O=S(=O)(c2ccc(c1nnnn1)cc2)NCB(O)O
InChi:InChI=1S/C8H10BN5O4S/c15-9(16)5-10-19(17,18)7-3-1-6(2-4-7)8-11-13-14-12-8/h1-4,10,15-16H,5H2,(H,11,12,13,14)
Definition date:2012-03-13
Last modified:2024-09-27
Release date:2012-09-21
Identifier:[({[4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid
0NA
0NA
Name:[({[6-(1H-tetrazol-5-yl)pyridin-3-yl]sulfonyl}amino)methyl]boronic acid
Formula:C7 H9 B N6 O4 S
SMILES:O=S(=O)(c2cnc(c1nnnn1)cc2)NCB(O)O
InChi:InChI=1S/C7H9BN6O4S/c15-8(16)4-10-19(17,18)5-1-2-6(9-3-5)7-11-13-14-12-7/h1-3,10,15-16H,4H2,(H,11,12,13,14)
Definition date:2012-03-16
Last modified:2024-09-27
Release date:2012-09-21
Identifier:[({[6-(1H-tetrazol-5-yl)pyridin-3-yl]sulfonyl}amino)methyl]boronic acid
0NB
0NB
Name:[({[3-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid
Formula:C8 H9 B Cl N5 O4 S
SMILES:O=S(=O)(c2cc(Cl)c(c1nnnn1)cc2)NCB(O)O
InChi:InChI=1S/C8H9BClN5O4S/c10-7-3-5(20(18,19)11-4-9(16)17)1-2-6(7)8-12-14-15-13-8/h1-3,11,16-17H,4H2,(H,12,13,14,15)
Definition date:2012-03-16
Last modified:2024-09-27
Release date:2012-09-21
Identifier:[({[3-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid
0NC
0NC
Name:N-methyl-L-alaninamide
Formula:C4 H10 N2 O
SMILES:O=C(NC)C(N)C
InChi:InChI=1S/C4H10N2O/c1-3(5)4(7)6-2/h3H,5H2,1-2H3,(H,6,7)/t3-/m0/s1
Definition date:2008-03-31
Last modified:2024-09-27
Identifier:N-methyl-L-alaninamide
0ND
0ND
Name:[({[2-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid
Formula:C8 H9 B Cl N5 O4 S
SMILES:O=S(=O)(c2c(Cl)cc(c1nnnn1)cc2)NCB(O)O
InChi:InChI=1S/C8H9BClN5O4S/c10-6-3-5(8-12-14-15-13-8)1-2-7(6)20(18,19)11-4-9(16)17/h1-3,11,16-17H,4H2,(H,12,13,14,15)
Definition date:2012-03-16
Last modified:2024-09-27
Release date:2012-09-21
Identifier:[({[2-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid
0NE
0NE
Name:[({[4-(1H-tetrazol-5-yl)-2-(trifluoromethyl)phenyl]sulfonyl}amino)methyl]boronic acid
Formula:C9 H9 B F3 N5 O4 S
SMILES:O=S(=O)(c2c(cc(c1nnnn1)cc2)C(F)(F)F)NCB(O)O
InChi:InChI=1S/C9H9BF3N5O4S/c11-9(12,13)6-3-5(8-15-17-18-16-8)1-2-7(6)23(21,22)14-4-10(19)20/h1-3,14,19-20H,4H2,(H,15,16,17,18)
Definition date:2012-03-16
Last modified:2024-09-27
Release date:2012-09-21
Identifier:[({[4-(1H-tetrazol-5-yl)-2-(trifluoromethyl)phenyl]sulfonyl}amino)methyl]boronic acid
0NG
0NG
Name:({[(chloromethyl)sulfonyl]amino}methyl)boronic acid
Formula:C2 H7 B Cl N O4 S
SMILES:ClCS(=O)(=O)NCB(O)O
InChi:InChI=1S/C2H7BClNO4S/c4-2-10(8,9)5-1-3(6)7/h5-7H,1-2H2
Definition date:2012-03-16
Last modified:2024-09-27
Release date:2012-09-21
Identifier:({[(chloromethyl)sulfonyl]amino}methyl)boronic acid
0OB
0OB
Name:3-(1-benzothiophen-2-yl)propanoic acid
Formula:C11 H10 O2 S
SMILES:O=C(O)CCc2sc1ccccc1c2
InChi:InChI=1S/C11H10O2S/c12-11(13)6-5-9-7-8-3-1-2-4-10(8)14-9/h1-4,7H,5-6H2,(H,12,13)
Definition date:2012-03-30
Last modified:2024-09-27
Release date:2012-10-05
Identifier:3-(1-benzothiophen-2-yl)propanoic acid
0P2
0P2
Name:N~2~-[(benzyloxy)carbonyl]-N-[(1R,2S)-1-(dihydroxyboranyl)-2-methylbutyl]-L-alaninamide
Formula:C16 H25 B N2 O5
SMILES:O=C(NC(B(O)O)C(C)CC)C(NC(=O)OCc1ccccc1)C
InChi:InChI=1S/C16H25BN2O5/c1-4-11(2)14(17(22)23)19-15(20)12(3)18-16(21)24-10-13-8-6-5-7-9-13/h5-9,11-12,14,22-23H,4,10H2,1-3H3,(H,18,21)(H,19,20)/t11-,12-,14-/m0/s1
Synonyms:ZAIB
Definition date:2008-09-14
Last modified:2024-09-27
Identifier:N~2~-[(benzyloxy)carbonyl]-N-[(1R,2S)-1-(dihydroxyboranyl)-2-methylbutyl]-L-alaninamide
0PC
0PC
Name:Nalpha-[(benzyloxy)carbonyl]-N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-L-phenylalaninamide
Formula:C21 H23 Cl N2 O4
SMILES:ClCC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)Cc2ccccc2)C
InChi:InChI=1S/C21H23ClN2O4/c1-15(19(25)13-22)23-20(26)18(12-16-8-4-2-5-9-16)24-21(27)28-14-17-10-6-3-7-11-17/h2-11,15,18H,12-14H2,1H3,(H,23,26)(H,24,27)/t15-,18-/m0/s1
Synonyms:ZPACK
Definition date:2008-09-14
Last modified:2024-09-27
Identifier:Nalpha-[(benzyloxy)carbonyl]-N-[(2S)-4-chloro-3-oxobutan-2-yl]-L-phenylalaninamide
0QE
0QE
Name:chloromethane
Formula:C H3 Cl
SMILES:ClC
InChi:InChI=1S/CH3Cl/c1-2/h1H3
Synonyms:Chloro Methyl group
Definition date:2008-12-08
Last modified:2024-09-27
Identifier:chloromethane
0QG
0QG
Name:3-methyl-L-valyl-L-prolyl-L-isoleucine
Formula:C17 H31 N3 O4
SMILES:O=C(NC(C(=O)O)C(C)CC)C1N(C(=O)C(N)C(C)(C)C)CCC1
InChi:InChI=1S/C17H31N3O4/c1-6-10(2)12(16(23)24)19-14(21)11-8-7-9-20(11)15(22)13(18)17(3,4)5/h10-13H,6-9,18H2,1-5H3,(H,19,21)(H,23,24)/t10-,11-,12-,13+/m0/s1
Definition date:2008-09-14
Last modified:2024-09-27
Identifier:3-methyl-L-valyl-L-prolyl-L-isoleucine
0QL
0QL
Name:3-[(2-aminoethyl)disulfanyl]-L-alanine
Formula:C5 H12 N2 O2 S2
SMILES:O=C(O)C(N)CSSCCN
InChi:InChI=1S/C5H12N2O2S2/c6-1-2-10-11-3-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1
Synonyms:CYS-MTSEA
Definition date:2012-04-16
Last modified:2024-09-27
Identifier:3-[(2-aminoethyl)disulfanyl]-L-alanine
0QZ
0QZ
Name:D-Isoserine
Formula:C3 H7 N O3
SMILES:O=C(O)C(O)CN
InChi:InChI=1S/C3H7NO3/c4-1-2(5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m1/s1
Synonyms:(2R)-3-amino-2-hydroxypropanoic acid
Definition date:2012-08-23
Last modified:2024-09-27
Release date:2014-05-07
Identifier:(2R)-3-amino-2-hydroxypropanoic acid
0RJ
0RJ
Name:3-(formylamino)-L-alanine
Formula:C4 H8 N2 O3
SMILES:O=CNCC(N)C(=O)O
InChi:InChI=1S/C4H8N2O3/c5-3(4(8)9)1-6-2-7/h2-3H,1,5H2,(H,6,7)(H,8,9)/t3-/m0/s1
Definition date:2012-08-23
Last modified:2024-09-27
Release date:2014-07-30
Identifier:3-(formylamino)-L-alanine
0S1
0S1
Name:N-((1R,2S)-2-allyl-4-oxocyclobutyl)-4-methylbenzenesulfonamide, bound form
Formula:C14 H19 N O3 S
SMILES:O=S(=O)(NC1C(CC=C)CC1O)c2ccc(cc2)C
InChi:InChI=1S/C14H19NO3S/c1-3-4-11-9-13(16)14(11)15-19(17,18)12-7-5-10(2)6-8-12/h3,5-8,11,13-16H,1,4,9H2,2H3/t11-,13-,14+/m0/s1
Definition date:2012-05-14
Last modified:2024-09-27
Release date:2012-08-24
Identifier:N-[(1R,2S,4S)-2-hydroxy-4-(prop-2-en-1-yl)cyclobutyl]-4-methylbenzenesulfonamide
0SK
0SK
Name:8-(hydroxyamino)-2-[(2S)-2-methyl-1,4-dioxa-8-azaspiro[4.5]dec-8-yl]-6-(trifluoromethyl)-4H-1,3-benzothiazin-4-one
Formula:C17 H18 F3 N3 O4 S
SMILES:FC(F)(F)c2cc(c1SC(=NC(=O)c1c2)N4CCC3(OCC(O3)C)CC4)NO
InChi:InChI=1S/C17H18F3N3O4S/c1-9-8-26-16(27-9)2-4-23(5-3-16)15-21-14(24)11-6-10(17(18,19)20)7-12(22-25)13(11)28-15/h6-7,9,22,25H,2-5,8H2,1H3/t9-/m0/s1
Definition date:2012-05-23
Last modified:2024-09-27
Release date:2012-08-31
Identifier:8-(hydroxyamino)-2-[(2S)-2-methyl-1,4-dioxa-8-azaspiro[4.5]dec-8-yl]-6-(trifluoromethyl)-4H-1,3-benzothiazin-4-one
0T4
0T4
Name:3-(hydroxyamino)-N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)benzamide
Formula:C16 H15 F3 N2 O2
SMILES:FC(F)(F)c1cc(cc(NO)c1)C(=O)NC(c2ccccc2)C
InChi:InChI=1S/C16H15F3N2O2/c1-10(11-5-3-2-4-6-11)20-15(22)12-7-13(16(17,18)19)9-14(8-12)21-23/h2-10,21,23H,1H3,(H,20,22)/t10-/m1/s1
Definition date:2012-05-30
Last modified:2024-09-27
Identifier:3-(hydroxyamino)-N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)benzamide
0TD
0TD
Name:(3S)-3-(methylsulfanyl)-L-aspartic acid
Formula:C5 H9 N O4 S
SMILES:O=C(O)C(N)C(SC)C(=O)O
InChi:InChI=1S/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3-/m0/s1
Definition date:2012-02-22
Last modified:2024-09-27
Release date:2012-11-09
Identifier:(3S)-3-(methylsulfanyl)-L-aspartic acid
0TI
0TI
Name:(3R)-5-fluoro-3-hydroxy-1,3-dihydro-2H-indol-2-one
Formula:C8 H6 F N O2
SMILES:c2cc1NC(=O)C(O)c1cc2F
InChi:InChI=1S/C8H6FNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3,7,11H,(H,10,12)/t7-/m1/s1
Definition date:2016-03-16
Last modified:2024-09-27
Release date:2016-05-25
Identifier:(3R)-5-fluoro-3-hydroxy-1,3-dihydro-2H-indol-2-one
0TJ
0TJ
Name:N-(6-oxohexyl)-2-(4,5,6,7-tetrabromo-1H-benzimidazol-1-yl)acetamide
Formula:C15 H15 Br4 N3 O3
SMILES:O=CCCCCCNC(=O)Cn1c2c(Br)c(Br)c(Br)c(Br)c2nc1
InChi:InChI=1S/C15H15Br4N3O3/c16-10-11(17)13(19)15-14(12(10)18)21-7-22(15)6-8(23)20-5-3-1-2-4-9(24)25/h7H,1-6H2,(H,20,23)(H,24,25)
Definition date:2012-06-06
Last modified:2024-09-27
Release date:2012-10-12
Identifier:N-(6-oxohexyl)-2-(4,5,6,7-tetrabromo-1H-benzimidazol-1-yl)acetamide
0U7
0U7
Name:3-[5-(3,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride
Formula:C14 H7 Cl2 F N2 O3 S
SMILES:FS(=O)(=O)c3cccc(c1nnc(o1)c2cc(Cl)cc(Cl)c2)c3
InChi:InChI=1S/C14H7Cl2FN2O3S/c15-10-4-9(5-11(16)7-10)14-19-18-13(22-14)8-2-1-3-12(6-8)23(17,20)21/h1-7H
Definition date:2012-06-15
Last modified:2024-09-27
Release date:2013-02-15
Identifier:3-[5-(3,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride
0UA
0UA
Name:3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride
Formula:C14 H7 Cl2 F N2 O4 S
SMILES:FS(=O)(=O)c3cccc(c1nnc(o1)c2cc(Cl)c(O)c(Cl)c2)c3
InChi:InChI=1S/C14H7Cl2FN2O4S/c15-10-5-8(6-11(16)12(10)20)14-19-18-13(23-14)7-2-1-3-9(4-7)24(17,21)22/h1-6,20H
Definition date:2012-06-15
Last modified:2024-09-27
Release date:2013-02-15
Identifier:3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride
0UC
0UC
Name:4-bromo-3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride
Formula:C14 H6 Br Cl2 F N2 O4 S
SMILES:FS(=O)(=O)c3ccc(Br)c(c1nnc(o1)c2cc(Cl)c(O)c(Cl)c2)c3
InChi:InChI=1S/C14H6BrCl2FN2O4S/c15-9-2-1-7(25(18,22)23)5-8(9)14-20-19-13(24-14)6-3-10(16)12(21)11(17)4-6/h1-5,21H
Definition date:2012-06-15
Last modified:2024-09-27
Release date:2013-02-15
Identifier:4-bromo-3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride

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數據於2025-10-15公開中

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