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Z7Z

Z7Z
Name:	biphenyl-4-carboxylic acid
Formula:	C13 H10 O2
SMILES:	O=C(O)c2ccc(c1ccccc1)cc2
InChi:	InChI=1S/C13H10O2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15)
Definition date:	2012-12-17
Last modified:	2023-11-03
Release date:	2021-09-01
Identifier:	biphenyl-4-carboxylic acid

KCR

KCR
Name:	N-6-crotonyl-L-lysine
Formula:	C10 H18 N2 O3
SMILES:	NC(C(O)=O)CCCCNC(=O)[C@H]=[C@H]C
InChi:	InChI=1S/C10H18N2O3/c1-2-5-9(13)12-7-4-3-6-8(11)10(14)15/h2,5,8H,3-4,6-7,11H2,1H3,(H,12,13)(H,14,15)/b5-2+/t8-/m0/s1
Definition date:	2015-03-26
Last modified:	2023-11-03
Release date:	2015-09-16
Identifier:	N~6~-[(2E)-but-2-enoyl]-L-lysine

OFX

OFX
Name:	2-(1H-benzotriazol-1-yl)-N-[4-(dimethylamino)phenyl]-N-[(1H-pyrazol-5-yl)methyl]acetamide
Formula:	C20 H21 N7 O
SMILES:	O=C(Cn1nnc2ccccc21)N(Cc1ccn[NH]1)c1ccc(cc1)N(C)C
InChi:	InChI=1S/C20H21N7O/c1-25(2)16-7-9-17(10-8-16)26(13-15-11-12-21-22-15)20(28)14-27-19-6-4-3-5-18(19)23-24-27/h3-12H,13-14H2,1-2H3,(H,21,22)
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(1H-benzotriazol-1-yl)-N-[4-(dimethylamino)phenyl]-N-[(1H-pyrazol-5-yl)methyl]acetamide

NM0

NM0
Name:	2-(3-chlorophenyl)-N-[(4R)-imidazo[1,2-a]pyridin-3-yl]acetamide
Formula:	C15 H12 Cl N3 O
SMILES:	Clc1cccc(c1)CC(=O)Nc1cnc2ccccn12
InChi:	InChI=1S/C15H12ClN3O/c16-12-5-3-4-11(8-12)9-15(20)18-14-10-17-13-6-1-2-7-19(13)14/h1-8,10H,9H2,(H,18,20)
Definition date:	2023-08-16
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chlorophenyl)-N-[(4R)-imidazo[1,2-a]pyridin-3-yl]acetamide

08M

08M
Name:	N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine
Formula:	C10 H14 N4 O3
SMILES:	O=C(NCCCC(C(=O)O)N)c1nccnc1
InChi:	InChI=1S/C10H14N4O3/c11-7(10(16)17)2-1-3-14-9(15)8-6-12-4-5-13-8/h4-7H,1-3,11H2,(H,14,15)(H,16,17)/t7-/m0/s1
Definition date:	2011-10-13
Last modified:	2023-11-03
Identifier:	N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine

VTN

VTN
Name:	N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide
Formula:	C18 H14 Cl2 N2 O2
SMILES:	Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)CCNC(=O)C=C
InChi:	InChI=1S/C18H14Cl2N2O2/c1-2-18(23)22-6-5-12-3-4-16(20)17(9-12)24-15-8-13(11-21)7-14(19)10-15/h2-4,7-10H,1,5-6H2,(H,22,23)
Definition date:	2023-09-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide

UKY

UKY
Name:	3-(5-phosphono-1H-1,2,3-triazol-1-yl)-L-alanine
Formula:	C5 H9 N4 O5 P
SMILES:	C(O)(C(N)Cn1c(P(=O)(O)O)cnn1)=O
InChi:	InChI=1S/C5H9N4O5P/c6-3(5(10)11)2-9-4(1-7-8-9)15(12,13)14/h1,3H,2,6H2,(H,10,11)(H2,12,13,14)/t3-/m0/s1
Definition date:	2020-05-20
Last modified:	2023-11-03
Release date:	2021-02-03
Identifier:	3-(5-phosphono-1H-1,2,3-triazol-1-yl)-L-alanine

O0R

O0R
Name:	2-(3-chlorophenyl)-N-(4-cyclopropylpyridin-3-yl)acetamide
Formula:	C16 H15 Cl N2 O
SMILES:	O=C(Nc1cnccc1C1CC1)Cc1cccc(Cl)c1
InChi:	InChI=1S/C16H15ClN2O/c17-13-3-1-2-11(8-13)9-16(20)19-15-10-18-7-6-14(15)12-4-5-12/h1-3,6-8,10,12H,4-5,9H2,(H,19,20)
Definition date:	2023-08-16
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chlorophenyl)-N-(4-cyclopropylpyridin-3-yl)acetamide

TCQ

TCQ
Name:	(1S,2R)-N-{(1E)-5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene}-2-phenylcyclopropanaminium
Formula:	C18 H19 N2 O4
SMILES:	O=C(O)C(N)CC=3C(=O)C=C(O)C(=[NH+]C2CC2c1ccccc1)C=3
InChi:	InChI=1S/C18H18N2O4/c19-13(18(23)24)6-11-7-15(17(22)9-16(11)21)20-14-8-12(14)10-4-2-1-3-5-10/h1-5,7,9,12-14,22H,6,8,19H2,(H,23,24)/p+1/b20-15+/t12-,13+,14+/m1/s1
Definition date:	2004-07-27
Last modified:	2023-11-03
Identifier:	(1S,2R)-N-{(1E)-5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene}-2-phenylcyclopropanaminium

VTS

VTS
Name:	N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide
Formula:	C19 H16 Cl2 N2 O3
SMILES:	Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)OCCN(C)C(=O)C=C
InChi:	InChI=1S/C19H16Cl2N2O3/c1-3-19(24)23(2)6-7-25-15-4-5-17(21)18(11-15)26-16-9-13(12-22)8-14(20)10-16/h3-5,8-11H,1,6-7H2,2H3
Definition date:	2023-09-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide

TRF

TRF
Name:	N1-FORMYL-TRYPTOPHAN
Formula:	C12 H12 N2 O3
SMILES:	O=C(O)C(N)Cc2c1ccccc1n(c2)C=O
InChi:	InChI=1S/C12H12N2O3/c13-10(12(16)17)5-8-6-14(7-15)11-4-2-1-3-9(8)11/h1-4,6-7,10H,5,13H2,(H,16,17)/t10-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	1-formyl-L-tryptophan

YOF

YOF
Name:	3-FLUOROTYROSINE
Formula:	C9 H10 F N O3
SMILES:	Fc1cc(ccc1O)CC(C(=O)O)N
InChi:	InChI=1S/C9H10FNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	3-fluoro-L-tyrosine

O0X

O0X
Name:	2-(3-chlorophenyl)-N-(1,7-naphthyridin-5-yl)acetamide
Formula:	C16 H12 Cl N3 O
SMILES:	Clc1cccc(c1)CC(=O)Nc1cncc2ncccc21
InChi:	InChI=1S/C16H12ClN3O/c17-12-4-1-3-11(7-12)8-16(21)20-15-10-18-9-14-13(15)5-2-6-19-14/h1-7,9-10H,8H2,(H,20,21)
Definition date:	2023-08-16
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chlorophenyl)-N-(1,7-naphthyridin-5-yl)acetamide

OG9

OG9
Name:	(pyren-1-yl)acetic acid
Formula:	C18 H12 O2
SMILES:	O=C(O)Cc1ccc2ccc3cccc4ccc1c2c34
InChi:	InChI=1S/C18H12O2/c19-16(20)10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)18(13)17(11)12/h1-9H,10H2,(H,19,20)
Definition date:	2022-04-29
Last modified:	2023-11-03
Release date:	2023-05-10
Identifier:	(pyren-1-yl)acetic acid

VTV

VTV
Name:	N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}-N-methylprop-2-enamide
Formula:	C19 H16 Cl2 N2 O2
SMILES:	Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)CCN(C)C(=O)C=C
InChi:	InChI=1S/C19H16Cl2N2O2/c1-3-19(24)23(2)7-6-13-4-5-17(21)18(10-13)25-16-9-14(12-22)8-15(20)11-16/h3-5,8-11H,1,6-7H2,2H3
Definition date:	2023-09-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}-N-methylprop-2-enamide

UZ4

UZ4
Name:	(2R,3S)-3-amino-2-hydroxy-4-[(3S)-2-oxopyrrolidin-3-yl]butanoic acid
Formula:	C8 H14 N2 O4
SMILES:	NC(C(O)C(O)=O)CC1CCNC1=O
InChi:	InChI=1S/C8H14N2O4/c9-5(6(11)8(13)14)3-4-1-2-10-7(4)12/h4-6,11H,1-3,9H2,(H,10,12)(H,13,14)/t4-,5-,6+/m0/s1
Definition date:	2020-06-08
Last modified:	2023-11-03
Release date:	2020-06-17
Identifier:	(2R,3S)-3-amino-2-hydroxy-4-[(3S)-2-oxopyrrolidin-3-yl]butanoic acid

Q3U

Q3U
Name:	N-(5-aminopyridin-3-yl)-N'-(3-chlorophenyl)urea
Formula:	C12 H11 Cl N4 O
SMILES:	O=C(Nc1cc(N)cnc1)Nc1cccc(Cl)c1
InChi:	InChI=1S/C12H11ClN4O/c13-8-2-1-3-10(4-8)16-12(18)17-11-5-9(14)6-15-7-11/h1-7H,14H2,(H2,16,17,18)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(5-aminopyridin-3-yl)-N'-(3-chlorophenyl)urea

X9B

X9B
Name:	(2P)-3-(3-chloro-2-methoxyanilino)-2-[3-(2-methoxy-2-methylpropoxy)pyridin-4-yl]-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one
Formula:	C24 H27 Cl N4 O4
SMILES:	CC(C)(OC)COc1cnccc1c1[NH]c2CCNC(=O)c2c1Nc1cccc(Cl)c1OC
InChi:	InChI=1S/C24H27ClN4O4/c1-24(2,32-4)13-33-18-12-26-10-8-14(18)20-21(19-16(28-20)9-11-27-23(19)30)29-17-7-5-6-15(25)22(17)31-3/h5-8,10,12,28-29H,9,11,13H2,1-4H3,(H,27,30)
Definition date:	2022-11-07
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(2P)-3-(3-chloro-2-methoxyanilino)-2-[3-(2-methoxy-2-methylpropoxy)pyridin-4-yl]-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one

OGF

OGF
Name:	2-(1H-benzotriazol-1-yl)-N-[4-(methylcarbamamido)phenyl]-N-[(thiophen-3-yl)methyl]acetamide
Formula:	C21 H20 N6 O2 S
SMILES:	O=C(Cn1nnc2ccccc21)N(Cc1ccsc1)c1ccc(NC(=O)NC)cc1
InChi:	InChI=1S/C21H20N6O2S/c1-22-21(29)23-16-6-8-17(9-7-16)26(12-15-10-11-30-14-15)20(28)13-27-19-5-3-2-4-18(19)24-25-27/h2-11,14H,12-13H2,1H3,(H2,22,23,29)
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(1H-benzotriazol-1-yl)-N-[4-(methylcarbamamido)phenyl]-N-[(thiophen-3-yl)methyl]acetamide

TRN

TRN
Name:	NZ2-TRYPTOPHAN
Formula:	C10 H11 N3 O2
SMILES:	O=C(O)C(N)Cc2c1cccnc1nc2
InChi:	InChI=1S/C10H11N3O2/c11-8(10(14)15)4-6-5-13-9-7(6)2-1-3-12-9/h1-3,5,8H,4,11H2,(H,12,13)(H,14,15)/t8-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	3-(1H-pyrrolo[2,3-b]pyridin-3-yl)-L-alanine

X9H

X9H
Name:	N-[(5P,8S,10R)-4-amino-6-methyl-5-(quinolin-3-yl)-8,9-dihydropyrimido[5,4-b]indolizin-8-yl]prop-2-enamide
Formula:	C23 H20 N6 O
SMILES:	C=CC(=O)NC1C=C(C)c2c(c3c(ncnc3N)n2C1)c1cc2ccccc2nc1
InChi:	InChI=1S/C23H20N6O/c1-3-18(30)28-16-8-13(2)21-19(15-9-14-6-4-5-7-17(14)25-10-15)20-22(24)26-12-27-23(20)29(21)11-16/h3-10,12,16H,1,11H2,2H3,(H,28,30)(H2,24,26,27)/t16-/m0/s1
Definition date:	2022-11-07
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-[(5P,8S,10R)-4-amino-6-methyl-5-(quinolin-3-yl)-8,9-dihydropyrimido[5,4-b]indolizin-8-yl]prop-2-enamide

TRO

TRO
Name:	2-HYDROXY-TRYPTOPHAN
Formula:	C11 H12 N2 O3
SMILES:	O=C(O)C(N)Cc2c1ccccc1nc2O
InChi:	InChI=1S/C11H12N2O3/c12-8(11(15)16)5-7-6-3-1-2-4-9(6)13-10(7)14/h1-4,8,13-14H,5,12H2,(H,15,16)/t8-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	2-hydroxy-L-tryptophan

TRP

TRP
Name:	TRYPTOPHAN
Formula:	C11 H12 N2 O2
SMILES:	O=C(O)C(N)Cc2c1ccccc1nc2
InChi:	InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	L-tryptophan

NMI

NMI
Name:	3-(1-methyl-1H-indol-3-yl)propanoic acid
Formula:	C12 H13 N O2
SMILES:	O=C(O)CCc2c1ccccc1n(c2)C
InChi:	InChI=1S/C12H13NO2/c1-13-8-9(6-7-12(14)15)10-4-2-3-5-11(10)13/h2-5,8H,6-7H2,1H3,(H,14,15)
Definition date:	2014-04-07
Last modified:	2023-11-03
Release date:	2014-06-18
Identifier:	3-(1-methyl-1H-indol-3-yl)propanoic acid

TRQ

TRQ
Name:	2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO-1H-INDOL-3-YL)-PROPIONIC ACID
Formula:	C11 H10 N2 O4
SMILES:	O=C(O)C(N)Cc2c1C=CC(=O)C(=O)c1nc2
InChi:	InChI=1S/C11H10N2O4/c12-7(11(16)17)3-5-4-13-9-6(5)1-2-8(14)10(9)15/h1-2,4,7,13H,3,12H2,(H,16,17)/t7-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	3-(6,7-dioxo-6,7-dihydro-1H-indol-3-yl)-L-alanine

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