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SNM

SNM
Name:	N,N-dimethyl-L-serine
Formula:	C5 H11 N O3
SMILES:	CN(C)[CH](CO)C(O)=O
InChi:	InChI=1S/C5H11NO3/c1-6(2)4(3-7)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1
Definition date:	2017-12-12
Last modified:	2023-11-03
Release date:	2018-05-30
Identifier:	(2~{S})-2-(dimethylamino)-3-oxidanyl-propanoic acid

SNN

SNN
Name:	L-3-AMINOSUCCINIMIDE
Formula:	C4 H6 N2 O2
SMILES:	O=C1NC(=O)C(N)C1
InChi:	InChI=1S/C4H6N2O2/c5-2-1-3(7)6-4(2)8/h2H,1,5H2,(H,6,7,8)/t2-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	(3S)-3-aminopyrrolidine-2,5-dione

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:	2023-11-03
Release date:	2012-11-09
Identifier:	(3S)-3-(methylsulfanyl)-L-aspartic acid

KWR

KWR
Name:	N-(3-{[(2S)-4-oxoazetidin-2-yl]oxy}phenyl)-2-(pyridin-3-yl)acetamide
Formula:	C16 H15 N3 O3
SMILES:	O=C(Cc1cccnc1)Nc1cccc(c1)OC1CC(=O)N1
InChi:	InChI=1S/C16H15N3O3/c20-14(7-11-3-2-6-17-10-11)18-12-4-1-5-13(8-12)22-16-9-15(21)19-16/h1-6,8,10,16H,7,9H2,(H,18,20)(H,19,21)/t16-/m0/s1
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(3-{[(2S)-4-oxoazetidin-2-yl]oxy}phenyl)-2-(pyridin-3-yl)acetamide

NCB

NCB
Name:	N-CARBAMOYL-ALANINE
Formula:	C4 H8 N2 O3
SMILES:	O=C(O)C(NC(=O)N)C
InChi:	InChI=1S/C4H8N2O3/c1-2(3(7)8)6-4(5)9/h2H,1H3,(H,7,8)(H3,5,6,9)/t2-/m1/s1
Definition date:	1999-10-10
Last modified:	2023-11-03
Identifier:	N-carbamoyl-D-alanine

KWS

KWS
Name:	{2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-methylidene-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C9 H13 N3 O4
SMILES:	O=C1C(N=C(N1CC(=O)O)C(N)C(O)C)=C
InChi:	InChI=1S/C9H13N3O4/c1-4-9(16)12(3-6(14)15)8(11-4)7(10)5(2)13/h5,7,13H,1,3,10H2,2H3,(H,14,15)/t5-,7+/m1/s1
Synonyms:	PEPTIDE DERIVED CHROMOPHORE
Definition date:	2011-11-18
Last modified:	2023-11-03
Identifier:	{2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-methylidene-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

KX9

KX9
Name:	(2R)-2-(3-chlorophenyl)-N-[(4M)-4-(1H-pyrazol-1-yl)pyridin-3-yl]propanamide
Formula:	C17 H15 Cl N4 O
SMILES:	Clc1cccc(c1)C(C)C(=O)Nc1cnccc1n1cccn1
InChi:	InChI=1S/C17H15ClN4O/c1-12(13-4-2-5-14(18)10-13)17(23)21-15-11-19-8-6-16(15)22-9-3-7-20-22/h2-12H,1H3,(H,21,23)/t12-/m1/s1
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(2R)-2-(3-chlorophenyl)-N-[(4M)-4-(1H-pyrazol-1-yl)pyridin-3-yl]propanamide

KXF

KXF
Name:	2-(3-hydroxyphenyl)-N-(4-methylpyridin-3-yl)acetamide
Formula:	C14 H14 N2 O2
SMILES:	O=C(Nc1cnccc1C)Cc1cccc(O)c1
InChi:	InChI=1S/C14H14N2O2/c1-10-5-6-15-9-13(10)16-14(18)8-11-3-2-4-12(17)7-11/h2-7,9,17H,8H2,1H3,(H,16,18)
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-hydroxyphenyl)-N-(4-methylpyridin-3-yl)acetamide

2SO

2SO
Name:	3-{3-[(3R)-3,4-dihydroxybutyl]-1-(8-phenyloctyl)-1H-imidazol-3-ium-5-yl}-L-alanine
Formula:	C24 H38 N3 O4
SMILES:	O=C(O)C(N)Cc1c[n+](cn1CCCCCCCCc2ccccc2)CCC(O)CO
InChi:	InChI=1S/C24H37N3O4/c25-23(24(30)31)16-21-17-26(15-13-22(29)18-28)19-27(21)14-9-4-2-1-3-6-10-20-11-7-5-8-12-20/h5,7-8,11-12,17,19,22-23,28-29H,1-4,6,9-10,13-16,18,25H2/p+1/t22-,23+/m1/s1
Definition date:	2014-01-23
Last modified:	2023-11-03
Release date:	2014-01-29
Identifier:	3-{3-[(3R)-3,4-dihydroxybutyl]-1-(8-phenyloctyl)-1H-imidazol-3-ium-5-yl}-L-alanine

KXR

KXR
Name:	N-(3-fluoro-5-{[(2S)-4-oxoazetidin-2-yl]oxy}phenyl)-2-(pyrimidin-5-yl)acetamide
Formula:	C15 H13 F N4 O3
SMILES:	Fc1cc(cc(OC2CC(=O)N2)c1)NC(=O)Cc1cncnc1
InChi:	InChI=1S/C15H13FN4O3/c16-10-2-11(4-12(3-10)23-15-5-14(22)20-15)19-13(21)1-9-6-17-8-18-7-9/h2-4,6-8,15H,1,5H2,(H,19,21)(H,20,22)/t15-/m0/s1
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(3-fluoro-5-{[(2S)-4-oxoazetidin-2-yl]oxy}phenyl)-2-(pyrimidin-5-yl)acetamide

0UO

0UO
Name:	4-methoxy-L-tryptophan
Formula:	C12 H14 N2 O3
SMILES:	O=C(O)C(N)Cc2c1c(cccc1OC)nc2
InChi:	InChI=1S/C12H14N2O3/c1-17-10-4-2-3-9-11(10)7(6-14-9)5-8(13)12(15)16/h2-4,6,8,14H,5,13H2,1H3,(H,15,16)/t8-/m0/s1
Definition date:	2012-06-20
Last modified:	2023-11-03
Release date:	2012-09-21
Identifier:	4-methoxy-L-tryptophan

KXV

KXV
Name:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}ac etic acid
Formula:	C15 H17 N3 O5 S
SMILES:	NC(CS)C=1N(CC(=O)O)C(=O)C(N=1)=[C@H]c2ccc(c(c2)OC)O
InChi:	InChI=1S/C15H17N3O5S/c1-23-12-5-8(2-3-11(12)19)4-10-15(22)18(6-13(20)21)14(17-10)9(16)7-24/h2-5,9,19,24H,6-7,16H2,1H3,(H,20,21)/b10-4-/t9-/m0/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)-3-OMeY
Definition date:	2019-01-23
Last modified:	2023-11-03
Release date:	2019-06-12
Identifier:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

KY0

KY0
Name:	1-(3-chlorophenyl)-N-(4-methylpyridin-3-yl)cyclopropane-1-carboxamide
Formula:	C16 H15 Cl N2 O
SMILES:	O=C(Nc1cnccc1C)C1(CC1)c1cccc(Cl)c1
InChi:	InChI=1S/C16H15ClN2O/c1-11-5-8-18-10-14(11)19-15(20)16(6-7-16)12-3-2-4-13(17)9-12/h2-5,8-10H,6-7H2,1H3,(H,19,20)
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	1-(3-chlorophenyl)-N-(4-methylpyridin-3-yl)cyclopropane-1-carboxamide

0UZ

0UZ
Name:	(2R)-amino(3-chloro-4-hydroxyphenyl)ethanoic acid
Formula:	C8 H8 Cl N O3
SMILES:	Clc1cc(ccc1O)C(C(=O)O)N
InChi:	InChI=1S/C8H8ClNO3/c9-5-3-4(1-2-6(5)11)7(10)8(12)13/h1-3,7,11H,10H2,(H,12,13)/t7-/m1/s1
Definition date:	2012-06-27
Last modified:	2023-11-03
Identifier:	(2R)-amino(3-chloro-4-hydroxyphenyl)ethanoic acid

KY4

KY4
Name:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(2,3-difluoro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C14 H13 F2 N3 O4 S
SMILES:	NC(CS)C1=N/C(C(N1CC(O)=O)=O)=Cc2c(F)c(F)c(cc2)O
InChi:	InChI=1S/C14H13F2N3O4S/c15-11-6(1-2-9(20)12(11)16)3-8-14(23)19(4-10(21)22)13(18-8)7(17)5-24/h1-3,7,20,24H,4-5,17H2,(H,21,22)/b8-3-/t7-/m0/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)-2,3-F
Definition date:	2019-01-23
Last modified:	2023-11-03
Release date:	2019-06-12
Identifier:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(2,3-difluoro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

KY7

KY7
Name:	{(4Z)-2-[(1S)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C14 H14 N4 O6 S
SMILES:	NC(CS)C1=N/C(C(N1CC(=O)O)=O)=Cc2cc(c(cc2)O)[N+](=O)[O-]
InChi:	InChI=1S/C14H14N4O6S/c15-8(6-25)13-16-9(14(22)17(13)5-12(20)21)3-7-1-2-11(19)10(4-7)18(23)24/h1-4,8,19,25H,5-6,15H2,(H,20,21)/b9-3-/t8-/m1/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)-3-NO2
Definition date:	2019-01-23
Last modified:	2023-11-03
Release date:	2019-06-12
Identifier:	{(4Z)-2-[(1S)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

KYC

KYC
Name:	(2S)-2-(3-chlorophenyl)-2-(dimethylamino)-N-(4-methylpyridin-3-yl)acetamide
Formula:	C16 H18 Cl N3 O
SMILES:	O=C(Nc1cnccc1C)C(c1cccc(Cl)c1)N(C)C
InChi:	InChI=1S/C16H18ClN3O/c1-11-7-8-18-10-14(11)19-16(21)15(20(2)3)12-5-4-6-13(17)9-12/h4-10,15H,1-3H3,(H,19,21)/t15-/m0/s1
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(2S)-2-(3-chlorophenyl)-2-(dimethylamino)-N-(4-methylpyridin-3-yl)acetamide

2TL

2TL
Name:	D-allothreonine
Formula:	C4 H9 N O3
SMILES:	O=C(O)C(N)C(O)C
InChi:	InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1
Definition date:	2008-06-03
Last modified:	2023-11-03
Identifier:	D-allothreonine

KYN

KYN
Name:	(2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid
Formula:	C10 H12 N2 O3
SMILES:	O=C(c1ccccc1N)CC(C(=O)O)N
InChi:	InChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1
Synonyms:	L-KYNURENINE
Definition date:	2004-05-16
Last modified:	2023-11-03
Identifier:	(2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid

KYQ

KYQ
Name:	(E)-N~6~-(1-carboxy-2-hydroxyethylidene)-L-lysine
Formula:	C9 H16 N2 O5
SMILES:	O=C(O)C(N)CCCC/N=C(/C(=O)O)CO
InChi:	InChI=1S/C9H16N2O5/c10-6(8(13)14)3-1-2-4-11-7(5-12)9(15)16/h6,12H,1-5,10H2,(H,13,14)(H,15,16)/b11-7+/t6-/m0/s1
Definition date:	2008-04-04
Last modified:	2023-11-03
Identifier:	(E)-N~6~-(1-carboxy-2-hydroxyethylidene)-L-lysine

KYU

KYU
Name:	2-(3-chlorophenyl)-2,2-difluoro-N-(4-methylpyridin-3-yl)acetamide
Formula:	C14 H11 Cl F2 N2 O
SMILES:	O=C(Nc1cnccc1C)C(F)(F)c1cccc(Cl)c1
InChi:	InChI=1S/C14H11ClF2N2O/c1-9-5-6-18-8-12(9)19-13(20)14(16,17)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,19,20)
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chlorophenyl)-2,2-difluoro-N-(4-methylpyridin-3-yl)acetamide

2TY

2TY
Name:	2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}-L-TYROSINE
Formula:	C17 H18 N2 O4
SMILES:	O=C(O)C(N)Cc2cc(N=CCc1ccccc1)c(O)cc2O
InChi:	InChI=1S/C17H18N2O4/c18-13(17(22)23)8-12-9-14(16(21)10-15(12)20)19-7-6-11-4-2-1-3-5-11/h1-5,7,9-10,13,20-21H,6,8,18H2,(H,22,23)/b19-7+/t13-/m0/s1
Definition date:	2005-07-07
Last modified:	2023-11-03
Identifier:	2-hydroxy-5-{[(1E)-2-phenylethylidene]amino}-L-tyrosine

KZ1

KZ1
Name:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-5-oxo-4-[(2,3,5-trifluoro-4-hydroxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C14 H12 F3 N3 O4 S
SMILES:	NC(CS)C1=N/C(C(N1CC(=O)O)=O)=Cc2c(c(c(c(c2)F)O)F)F
InChi:	InChI=1S/C14H12F3N3O4S/c15-6-1-5(10(16)11(17)12(6)23)2-8-14(24)20(3-9(21)22)13(19-8)7(18)4-25/h1-2,7,23,25H,3-4,18H2,(H,21,22)/b8-2-/t7-/m0/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)-(2,3,5-F3Y)
Definition date:	2019-01-25
Last modified:	2023-11-03
Release date:	2019-06-12
Identifier:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-5-oxo-4-[(2,3,5-trifluoro-4-hydroxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-1-yl}acetic acid

KZ4

KZ4
Name:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C14 H14 Br N3 O4 S
SMILES:	NC(CS)C=1N(C(=O)C(N=1)=[C@H]c2cc(c(cc2)O)Br)CC(=O)O
InChi:	InChI=1S/C14H14BrN3O4S/c15-8-3-7(1-2-11(8)19)4-10-14(22)18(5-12(20)21)13(17-10)9(16)6-23/h1-4,9,19,23H,5-6,16H2,(H,20,21)/b10-4-/t9-/m0/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)3-Br
Definition date:	2019-01-25
Last modified:	2023-11-03
Release date:	2019-06-12
Identifier:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

KZ7

KZ7
Name:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-chloro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C14 H14 Cl N3 O4 S
SMILES:	NC(CS)C=1N(CC(=O)O)C(=O)C(N=1)=[C@H]c2ccc(c(c2)Cl)O
InChi:	InChI=1S/C14H14ClN3O4S/c15-8-3-7(1-2-11(8)19)4-10-14(22)18(5-12(20)21)13(17-10)9(16)6-23/h1-4,9,19,23H,5-6,16H2,(H,20,21)/t9-/m0/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)3-Cl
Definition date:	2019-01-25
Last modified:	2023-11-03
Release date:	2019-06-12
Identifier:	{(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-chloro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

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