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CF0

CF0
Name:	fluoromethane
Formula:	C H3 F
SMILES:	FC
InChi:	InChI=1S/CH3F/c1-2/h1H3
Synonyms:	Fluoro methyl group
Definition date:	2009-01-06
Last modified:	2023-11-03
Identifier:	fluoromethane

CFY

CFY
Name:	[(4Z)-2-{(2R)-2-[(1S)-1-amino-2-phenylethyl]-2-hydroxy-2,5-dihydro-1,3-thiazol-4-yl}-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid
Formula:	C23 H22 N4 O5 S
SMILES:	O=C(O)CN1C(=O)C(N=C1C2=NC(O)(SC2)C(N)Cc3ccccc3)=Cc4ccc(O)cc4
InChi:	InChI=1S/C23H22N4O5S/c24-19(11-14-4-2-1-3-5-14)23(32)26-18(13-33-23)21-25-17(22(31)27(21)12-20(29)30)10-15-6-8-16(28)9-7-15/h1-10,19,28,32H,11-13,24H2,(H,29,30)/b17-10-/t19-,23+/m0/s1
Synonyms:	CHROMOPHORE (PHE-CYS-TYR-GLY)
Definition date:	2006-02-14
Last modified:	2023-11-03
Identifier:	[(4Z)-2-{(2R)-2-[(1S)-1-amino-2-phenylethyl]-2-hydroxy-2,5-dihydro-1,3-thiazol-4-yl}-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid

CG6

CG6
Name:	beta-Methyl-Cysteine
Formula:	C4 H9 N O2 S
SMILES:	C[CH](S)[CH](N)C(O)=O
InChi:	InChI=1S/C4H9NO2S/c1-2(8)3(5)4(6)7/h2-3,8H,5H2,1H3,(H,6,7)/t2-,3+/m1/s1
Definition date:	2015-11-26
Last modified:	2023-11-03
Release date:	2016-07-06
Identifier:	(2~{R},3~{R})-2-azanyl-3-sulfanyl-butanoic acid

CGA

CGA
Name:	CARBOXYMETHYLATED GLUTAMIC ACID
Formula:	C7 H11 N O6
SMILES:	O=C(O)COC(=O)CCC(C(=O)O)N
InChi:	InChI=1S/C7H11NO6/c8-4(7(12)13)1-2-6(11)14-3-5(9)10/h4H,1-3,8H2,(H,9,10)(H,12,13)
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	2-amino-5-(carboxymethoxy)-5-oxopentanoic acid (non-preferred name)

CHG

CHG
Name:	CYCLOHEXYL-GLYCINE
Formula:	C8 H15 N O2
SMILES:	O=C(O)C(N)C1CCCCC1
InChi:	InChI=1S/C8H15NO2/c9-7(8(10)11)6-4-2-1-3-5-6/h6-7H,1-5,9H2,(H,10,11)/t7-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	(2S)-amino(cyclohexyl)ethanoic acid

CHP

CHP
Name:	3-CHLORO-4-HYDROXYPHENYLGLYCINE
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-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	(2S)-amino(3-chloro-4-hydroxyphenyl)ethanoic acid

U2M

U2M
Name:	(2S)-2-amino-7-sulfanylheptanoic acid
Formula:	C7 H15 N O2 S
SMILES:	NC(C(O)=O)CCCCCS
InChi:	InChI=1S/C7H15NO2S/c8-6(7(9)10)4-2-1-3-5-11/h6,11H,1-5,8H2,(H,9,10)/t6-/m0/s1
Definition date:	2020-04-09
Last modified:	2023-11-03
Release date:	2021-04-21
Identifier:	(2S)-2-amino-7-sulfanylheptanoic acid

U2X

U2X
Name:	O-(cyclohexylmethyl)-L-tyrosine
Formula:	C16 H23 N O3
SMILES:	O=C(O)C(N)Cc2ccc(OCC1CCCCC1)cc2
InChi:	InChI=1S/C16H23NO3/c17-15(16(18)19)10-12-6-8-14(9-7-12)20-11-13-4-2-1-3-5-13/h6-9,13,15H,1-5,10-11,17H2,(H,18,19)/t15-/m0/s1
Definition date:	2012-01-12
Last modified:	2023-11-03
Identifier:	O-(cyclohexylmethyl)-L-tyrosine

U3X

U3X
Name:	4-[(cyclohexylmethyl)amino]-L-phenylalanine
Formula:	C16 H24 N2 O2
SMILES:	O=C(O)C(N)Cc2ccc(NCC1CCCCC1)cc2
InChi:	InChI=1S/C16H24N2O2/c17-15(16(19)20)10-12-6-8-14(9-7-12)18-11-13-4-2-1-3-5-13/h6-9,13,15,18H,1-5,10-11,17H2,(H,19,20)/t15-/m0/s1
Definition date:	2013-05-06
Last modified:	2023-11-03
Release date:	2013-06-19
Identifier:	4-[(cyclohexylmethyl)amino]-L-phenylalanine

CKC

CKC
Name:	(3S)-3,7-diaminoheptan-2-one
Formula:	C7 H16 N2 O
SMILES:	O=C(C)C(N)CCCCN
InChi:	InChI=1S/C7H16N2O/c1-6(10)7(9)4-2-3-5-8/h7H,2-5,8-9H2,1H3/t7-/m0/s1
Definition date:	2014-09-15
Last modified:	2023-11-03
Release date:	2014-10-08
Identifier:	(3S)-3,7-diaminoheptan-2-one

U6A

U6A
Name:	N-carboxy-L-threonine
Formula:	C5 H9 N O5
SMILES:	C(NC(C(C)O)C(=O)O)(O)=O
InChi:	InChI=1S/C5H9NO5/c1-2(7)3(4(8)9)6-5(10)11/h2-3,6-7H,1H3,(H,8,9)(H,10,11)/t2-,3+/m1/s1
Definition date:	2020-04-27
Last modified:	2023-11-03
Release date:	2020-09-23
Identifier:	N-carboxy-L-threonine

CLV

CLV
Name:	{(2S)-2-[(1S)-1-AMINOETHYL]-5-OXO-2,5-DIHYDRO-1H-IMIDAZOL-1-YL}ACETIC ACID
Formula:	C7 H11 N3 O3
SMILES:	O=C1C=NC(N1CC(=O)O)C(N)C
InChi:	InChI=1S/C7H11N3O3/c1-4(8)7-9-2-5(11)10(7)3-6(12)13/h2,4,7H,3,8H2,1H3,(H,12,13)/t4-,7-/m0/s1
Synonyms:	CHROMOPHORE (ALA-PHE-GLY)
Definition date:	2007-03-22
Last modified:	2023-11-03
Identifier:	{(2S)-2-[(1S)-1-aminoethyl]-5-oxo-2,5-dihydro-1H-imidazol-1-yl}acetic acid

CML

CML
Name:	(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acid
Formula:	C7 H11 N O6 S
SMILES:	O=C(O)C(N)CSC(C(=O)O)CC(=O)O
InChi:	InChI=1S/C7H11NO6S/c8-3(6(11)12)2-15-4(7(13)14)1-5(9)10/h3-4H,1-2,8H2,(H,9,10)(H,11,12)(H,13,14)/t3-,4-/m0/s1
Definition date:	2007-10-11
Last modified:	2023-11-03
Identifier:	(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acid

U8S

U8S
Name:	3-[(2S)-2-hydroxy-2,3-dihydro-1H-imidazol-4-yl]-L-alanine
Formula:	C6 H11 N3 O3
SMILES:	NC(CC1=CNC(O)N1)C(=O)O
InChi:	InChI=1S/C6H11N3O3/c7-4(5(10)11)1-3-2-8-6(12)9-3/h2,4,6,8-9,12H,1,7H2,(H,10,11)/t4-,6-/m0/s1
Definition date:	2022-08-10
Last modified:	2023-11-03
Release date:	2023-10-18
Identifier:	3-[(2S)-2-hydroxy-2,3-dihydro-1H-imidazol-4-yl]-L-alanine

CPN

CPN
Name:	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-CYTOSINE
Formula:	C10 H16 N5 O4
SMILES:	O=C(N(CC(=O)O)CC[NH3+])CN1C=CC(=NC1=O)N
InChi:	InChI=1S/C10H15N5O4/c11-2-4-14(6-9(17)18)8(16)5-15-3-1-7(12)13-10(15)19/h1,3H,2,4-6,11H2,(H,17,18)(H2,12,13,19)/p+1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	2-{[(4-amino-2-oxopyrimidin-1(2H)-yl)acetyl](carboxymethyl)amino}ethanaminium

CQ2

CQ2
Name:	{(4Z)-4-(4-aminobenzylidene)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C15 H18 N4 O4
SMILES:	O=C1C(N=C(N1CC(=O)O)C(N)C(O)C)=Cc2ccc(N)cc2
InChi:	InChI=1S/C15H18N4O4/c1-8(20)13(17)14-18-11(15(23)19(14)7-12(21)22)6-9-2-4-10(16)5-3-9/h2-6,8,13,20H,7,16-17H2,1H3,(H,21,22)/t8-,13+/m1/s1
Synonyms:	PEPTIDE DERIVED CHROMOPHORE
Definition date:	2013-02-21
Last modified:	2023-11-03
Release date:	2013-06-26
Identifier:	{(4Z)-4-(4-aminobenzylidene)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

UB4

UB4
Name:	(2S)-2-amino-4-(1,3-benzothiazol-2-yl)butanoic acid
Formula:	C11 H12 N2 O2 S
SMILES:	C(O)(C(CCc2nc1ccccc1s2)N)=O
InChi:	InChI=1S/C11H12N2O2S/c12-7(11(14)15)5-6-10-13-8-3-1-2-4-9(8)16-10/h1-4,7H,5-6,12H2,(H,14,15)/t7-/m0/s1
Definition date:	2020-05-06
Last modified:	2023-11-03
Release date:	2020-05-20
Identifier:	(2S)-2-amino-4-(1,3-benzothiazol-2-yl)butanoic acid

CR2

CR2
Name:	{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C13 H13 N3 O4
SMILES:	O=C1C(N=C(N1CC(=O)O)CN)=Cc2ccc(O)cc2
InChi:	InChI=1S/C13H13N3O4/c14-6-11-15-10(13(20)16(11)7-12(18)19)5-8-1-3-9(17)4-2-8/h1-5,17H,6-7,14H2,(H,18,19)/b10-5-
Synonyms:	CHROMOPHORE (GLY-TYR-GLY)
Definition date:	2003-01-03
Last modified:	2023-11-03
Identifier:	{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

CR8

CR8
Name:	2-[1-AMINO-2-(1H-IMIDAZOL-5-YL)ETHYL]-1-(CARBOXYMETHYL)-4-[(4-OXOCYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL]-1H-IMIDAZOL-5-OLATE
Formula:	C17 H16 N5 O4
SMILES:	O=C1C=C/C(C=C1)=Cc2nc(n(c2[O-])CC(=O)O)C(N)Cc3cncn3
InChi:	InChI=1S/C17H17N5O4/c18-13(6-11-7-19-9-20-11)16-21-14(17(26)22(16)8-15(24)25)5-10-1-3-12(23)4-2-10/h1-5,7,9,13,26H,6,8,18H2,(H,19,20)(H,24,25)/p-1/t13-/m0/s1
Synonyms:	CHROMOPHORE (HIS-TYR-GLY)
Definition date:	2005-06-14
Last modified:	2023-11-03
Identifier:	2-[(1S)-1-amino-2-(1H-imidazol-5-yl)ethyl]-1-(carboxymethyl)-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-imidazol-5-olate

SQ6

SQ6
Name:	2,2'-azanediyldiacetic acid
Formula:	C4 H7 N O4
SMILES:	O=C(O)CNCC(=O)O
InChi:	InChI=1S/C4H7NO4/c6-3(7)1-5-2-4(8)9/h5H,1-2H2,(H,6,7)(H,8,9)
Definition date:	2022-07-07
Last modified:	2023-11-03
Release date:	2022-12-07
Identifier:	2,2'-azanediyldiacetic acid

4V0

4V0
Name:	3-(3H-azepin-5-yl)-L-alanine
Formula:	C9 H12 N2 O2
SMILES:	NC(C(=O)O)CC1=CCC=NC=C1
InChi:	InChI=1S/C9H12N2O2/c10-8(9(12)13)6-7-2-1-4-11-5-3-7/h2-5,8H,1,6,10H2,(H,12,13)/t8-/m0/s1
Definition date:	2015-06-03
Last modified:	2023-11-03
Release date:	2016-07-13
Identifier:	3-(3H-azepin-5-yl)-L-alanine

4WQ

4WQ
Name:	(2S)-2-amino-7,7-dimethyloctanoic acid
Formula:	C10 H21 N O2
SMILES:	NC(C(=O)O)CCCCC(C)(C)C
InChi:	InChI=1S/C10H21NO2/c1-10(2,3)7-5-4-6-8(11)9(12)13/h8H,4-7,11H2,1-3H3,(H,12,13)/t8-/m0/s1
Definition date:	2015-06-12
Last modified:	2023-11-03
Release date:	2015-07-01
Identifier:	(2S)-2-amino-7,7-dimethyloctanoic acid

SWG

SWG
Name:	2-[(4Z)-2-[(1R)-1-amino-2-hydroxy-ethyl]-4-(1H-indol-3-ylmethylidene)-5-oxo-imidazol-1-yl]ethanoic acid
Formula:	C16 H16 N4 O4
SMILES:	N[CH](CO)C1=NC(=Cc2c[nH]c3ccccc23)C(=O)N1CC(O)=O
InChi:	InChI=1S/C16H16N4O4/c17-11(8-21)15-19-13(16(24)20(15)7-14(22)23)5-9-6-18-12-4-2-1-3-10(9)12/h1-6,11,18,21H,7-8,17H2,(H,22,23)/b13-5-/t11-/m0/s1
Definition date:	2011-03-25
Last modified:	2023-11-03
Identifier:	2-[(4Z)-2-[(1R)-1-amino-2-hydroxy-ethyl]-4-(1H-indol-3-ylmethylidene)-5-oxo-imidazol-1-yl]ethanoic acid

SWW

SWW
Name:	(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid
Formula:	C5 H11 N O3 S
SMILES:	N[CH](CSCCO)C(O)=O
InChi:	InChI=1S/C5H11NO3S/c6-4(5(8)9)3-10-2-1-7/h4,7H,1-3,6H2,(H,8,9)/t4-/m1/s1
Synonyms:	S-(2-hydroxyethyl)-D-cysteine
Definition date:	2020-12-02
Last modified:	2023-11-03
Release date:	2022-01-12
Identifier:	(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid

51T

51T
Name:	2,3,6-trifluoro-L-tyrosine
Formula:	C9 H8 F3 N O3
SMILES:	NC(Cc1c(cc(c(c1F)F)O)F)C(=O)O
InChi:	InChI=1S/C9H8F3NO3/c10-4-2-6(14)8(12)7(11)3(4)1-5(13)9(15)16/h2,5,14H,1,13H2,(H,15,16)/t5-/m0/s1
Definition date:	2015-07-13
Last modified:	2023-11-03
Release date:	2016-06-22
Identifier:	2,3,6-trifluoro-L-tyrosine

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