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ZXQ

ZXQ
Name:	{(3R,7S)-2-hydroxy-3-[2-(thiophen-2-yl)acetamido]-2,3,4,7-tetrahydro-1,2-oxaborepin-7-yl}acetic acid
Formula:	C13 H16 B N O5 S
SMILES:	O=C(NC1CC=CC(CC(=O)O)OB1O)Cc1cccs1
InChi:	InChI=1S/C13H16BNO5S/c16-12(8-10-4-2-6-21-10)15-11-5-1-3-9(7-13(17)18)20-14(11)19/h1-4,6,9,11,19H,5,7-8H2,(H,15,16)(H,17,18)/t9-,11+/m1/s1
Definition date:	2022-01-13
Last modified:	2024-09-27
Release date:	2022-05-18
Identifier:	{(3R,7S)-2-hydroxy-3-[2-(thiophen-2-yl)acetamido]-2,3,4,7-tetrahydro-1,2-oxaborepin-7-yl}acetic acid

ZGX

ZGX
Name:	1-(3,4-dihydropyrazin-1(2H)-yl)ethan-1-one
Formula:	C6 H10 N2 O
SMILES:	CC(=O)N1C=CNCC1
InChi:	InChI=1S/C6H10N2O/c1-6(9)8-4-2-7-3-5-8/h2,4,7H,3,5H2,1H3
Definition date:	2023-06-23
Last modified:	2024-09-27
Release date:	2023-07-12
Identifier:	1-(3,4-dihydropyrazin-1(2H)-yl)ethan-1-one

FSP

FSP
Name:	[1-(4-FLUOROBENZYL)CYCLOBUTYL]METHYL (1S)-1-[OXO(1H-PYRAZOL-5-YLAMINO)ACETYL]PENTYLCARBAMATE
Formula:	C23 H29 F N4 O4
SMILES:	O=C(C(=O)C(NC(=O)OCC2(Cc1ccc(F)cc1)CCC2)CCCC)Nc3ccnn3
InChi:	InChI=1S/C23H29FN4O4/c1-2-3-5-18(20(29)21(30)27-19-10-13-25-28-19)26-22(31)32-15-23(11-4-12-23)14-16-6-8-17(24)9-7-16/h6-10,13,18H,2-5,11-12,14-15H2,1H3,(H,26,31)(H2,25,27,28,30)/t18-/m0/s1
Definition date:	2004-07-12
Last modified:	2024-09-27
Identifier:	[1-(4-fluorobenzyl)cyclobutyl]methyl {(1S)-1-[oxo(1H-pyrazol-5-ylamino)acetyl]pentyl}carbamate

1LC

1LC
Name:	(2R)-2-cyano-3-[3-(1H-pyrrolo[2,3-b]pyridin-3-ylcarbonyl)phenyl]propanamide
Formula:	C18 H14 N4 O2
SMILES:	N#CC(C(=O)N)Cc1cccc(c1)C(=O)c3c2cccnc2nc3
InChi:	InChI=1S/C18H14N4O2/c19-9-13(17(20)24)8-11-3-1-4-12(7-11)16(23)15-10-22-18-14(15)5-2-6-21-18/h1-7,10,13H,8H2,(H2,20,24)(H,21,22)/t13-/m1/s1
Definition date:	2013-03-18
Last modified:	2024-09-27
Release date:	2013-04-10
Identifier:	(2R)-2-cyano-3-[3-(1H-pyrrolo[2,3-b]pyridin-3-ylcarbonyl)phenyl]propanamide

NWA

NWA
Name:	4,4-DIHYDROXY-N,N,N-TRIMETHYLPENTAN-1-AMINIUM
Formula:	C8 H20 N O2
SMILES:	OC(O)(C)CCC[N+](C)(C)C
InChi:	InChI=1S/C8H20NO2/c1-8(10,11)6-5-7-9(2,3)4/h10-11H,5-7H2,1-4H3/q+1
Definition date:	2005-10-27
Last modified:	2024-09-27
Identifier:	4,4-dihydroxy-N,N,N-trimethylpentan-1-aminium

FSQ

FSQ
Name:	(1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic Acid
Formula:	C8 H14 O5
SMILES:	C[C]1(O)C[CH](C[CH](O)[CH]1O)C(O)=O
InChi:	InChI=1S/C8H14O5/c1-8(13)3-4(7(11)12)2-5(9)6(8)10/h4-6,9-10,13H,2-3H2,1H3,(H,11,12)/t4-,5+,6-,8+/m0/s1
Definition date:	2018-07-25
Last modified:	2024-09-27
Release date:	2019-07-24
Identifier:	(1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid

FSR

FSR
Name:	(2S,3S,4R,5R,6R)-5-acetamido-2,3-bis(fluoranyl)-4-oxidanyl-6-[(1S,2S)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid
Formula:	C11 H17 F2 N O8
SMILES:	FC1(OC(C(NC(=O)C)C(O)C1F)C(O)C(O)CO)C(=O)O
InChi:	InChI=1S/C11H17F2NO8/c1-3(16)14-5-7(19)9(12)11(13,10(20)21)22-8(5)6(18)4(17)2-15/h4-9,15,17-19H,2H2,1H3,(H,14,16)(H,20,21)/t4-,5+,6-,7+,8+,9-,11+/m0/s1
Synonyms:	2,3-difluorosialic acid
Definition date:	2013-10-28
Last modified:	2024-09-27
Release date:	2013-12-25
Identifier:	(2R,3S,4R,5R,6R)-5-(acetylamino)-2,3-difluoro-4-hydroxy-6-[(1S,2S)-1,2,3-trihydroxypropyl]tetrahydro-2H-pyran-2-carboxy lic acid (non-preferred name)

1LE

1LE
Name:	(2S)-2-cyano-N-(1-hydroxy-2-methylpropan-2-yl)-3-[3-(3,4,5-trimethoxyphenyl)-1H-indazol-5-yl]propanamide
Formula:	C24 H28 N4 O5
SMILES:	N#CC(C(=O)NC(C)(C)CO)Cc1cc2c(cc1)nnc2c3cc(OC)c(OC)c(OC)c3
InChi:	InChI=1S/C24H28N4O5/c1-24(2,13-29)26-23(30)16(12-25)8-14-6-7-18-17(9-14)21(28-27-18)15-10-19(31-3)22(33-5)20(11-15)32-4/h6-7,9-11,16,29H,8,13H2,1-5H3,(H,26,30)(H,27,28)/t16-/m0/s1
Definition date:	2013-03-18
Last modified:	2024-09-27
Release date:	2013-04-10
Identifier:	(2S)-2-cyano-N-(1-hydroxy-2-methylpropan-2-yl)-3-[3-(3,4,5-trimethoxyphenyl)-1H-indazol-5-yl]propanamide

ZXW

ZXW
Name:	5'-O-[(S)-{[(R)-{[(R)-[(2-{[(2S)-2-amino-3-oxopropyl]amino}-2-oxoethyl)sulfanyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine
Formula:	C15 H24 N7 O15 P3 S
SMILES:	NC(CNC(CSP(OP(OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)O)(=O)O)(O)=O)=O)C=O
InChi:	InChI=1S/C15H24N7O15P3S/c16-6(15(26)27)1-18-8(23)3-41-40(32,33)37-39(30,31)36-38(28,29)34-2-7-10(24)11(25)14(35-7)22-5-21-9-12(17)19-4-20-13(9)22/h4-7,10-11,14,24-25H,1-3,16H2,(H,18,23)(H,26,27)(H,28,29)(H,30,31)(H,32,33)(H2,17,19,20)/t6-,7+,10+,11+,14+/m0/s1
Definition date:	2018-01-18
Last modified:	2024-09-27
Release date:	2018-08-22
Identifier:	5'-O-[(S)-{[(R)-{[(R)-[(2-{[(2S)-2-amino-3-oxopropyl]amino}-2-oxoethyl)sulfanyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine

NWJ

NWJ
Name:	2-amino-6-(3-formylphenyl)-4-(pyrrolidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Formula:	C18 H16 N6 O
SMILES:	O=Cc1cccc(c1)c3c(C#N)c2c(nc(nc2n3)N)N4CCCC4
InChi:	InChI=1S/C18H16N6O/c19-9-13-14-16(21-15(13)12-5-3-4-11(8-12)10-25)22-18(20)23-17(14)24-6-1-2-7-24/h3-5,8,10H,1-2,6-7H2,(H3,20,21,22,23)
Definition date:	2014-01-15
Last modified:	2024-09-27
Release date:	2015-01-21
Identifier:	2-amino-6-(3-formylphenyl)-4-(pyrrolidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

ZY9

ZY9
Name:	6-(aminomethyl)pyridine-2-carboxylic acid
Formula:	C7 H8 N2 O2
SMILES:	NCc1cccc(n1)C(O)=O
InChi:	InChI=1S/C7H8N2O2/c8-4-5-2-1-3-6(9-5)7(10)11/h1-3H,4,8H2,(H,10,11)
Definition date:	2018-10-24
Last modified:	2024-09-27
Release date:	2019-09-18
Identifier:	6-(aminomethyl)pyridine-2-carboxylic acid

ZHH

ZHH
Name:	2-(4-METHOXYPHENYL)ETHANAMINE
Formula:	C9 H13 N O
SMILES:	O(c1ccc(cc1)CCN)C
InChi:	InChI=1S/C9H13NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6-7,10H2,1H3
Definition date:	2006-10-27
Last modified:	2024-09-27
Identifier:	2-(4-methoxyphenyl)ethanamine

FT5

FT5
Name:	(3~{R})-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid
Formula:	C7 H12 O5
SMILES:	O[CH]1C[CH](C[CH](O)[CH]1O)C(O)=O
InChi:	InChI=1S/C7H12O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h3-6,8-10H,1-2H2,(H,11,12)/t3-,4+,5-,6-
Definition date:	2018-07-25
Last modified:	2024-09-27
Release date:	2019-07-24
Identifier:	(3~{R})-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid

ZYA

ZYA
Name:	BENZOYL-TYROSINE-ALANINE-FLUORO-METHYL KETONE
Formula:	C21 H23 F N2 O5
SMILES:	FCC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)Cc2ccc(O)cc2)C
InChi:	InChI=1S/C21H23FN2O5/c1-14(19(26)12-22)23-20(27)18(11-15-7-9-17(25)10-8-15)24-21(28)29-13-16-5-3-2-4-6-16/h2-10,14,18,25H,11-13H2,1H3,(H,23,27)(H,24,28)/t14-,18-/m0/s1
Synonyms:	Nalpha-[(benzyloxy)carbonyl]-N-[(2S)-4-fluoro-3-oxobutan-2-yl]-L-tyrosinamide
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	Nalpha-[(benzyloxy)carbonyl]-N-[(2S)-4-fluoro-3-oxobutan-2-yl]-L-tyrosinamide

FT6

FT6
Name:	6-FLUORO-L-TRYPTOPHAN
Formula:	C11 H11 F N2 O2
SMILES:	O=C(O)C(N)Cc2c1ccc(F)cc1nc2
InChi:	InChI=1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
Synonyms:	(S)-2-AMINO-3-(6-FLUORO-1H-INDOL-3-YL)PROPANOIC ACID
Definition date:	2006-11-20
Last modified:	2024-09-27
Identifier:	6-fluoro-L-tryptophan

1LU

1LU
Name:	(2S)-2-hydroxy-4-methyl-pentanoic acid
Formula:	C6 H12 O3
SMILES:	O=C(O)C(O)CC(C)C
InChi:	InChI=1S/C6H12O3/c1-4(2)3-5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t5-/m0/s1
Definition date:	2000-01-21
Last modified:	2024-09-27
Identifier:	(2S)-2-hydroxy-4-methylpentanoic acid

NX0

NX0
Name:	1-(2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)propan-1-one
Formula:	C10 H12 N2 O2
SMILES:	CCC(=O)N1CCOc2ncccc12
InChi:	InChI=1S/C10H12N2O2/c1-2-9(13)12-6-7-14-10-8(12)4-3-5-11-10/h3-5H,2,6-7H2,1H3
Synonyms:	1-(2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)prop-2-en-1-one (precursor)
Definition date:	2022-08-24
Last modified:	2024-09-27
Release date:	2022-09-28
Identifier:	1-(2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)propan-1-one

ZHW

ZHW
Name:	(1R)-1-amino-2,3-dihydro-1H-inden-4-yl sulfurofluoridate
Formula:	C9 H10 F N O3 S
SMILES:	FS(=O)(=O)Oc1cccc2c1CCC2N
InChi:	InChI=1S/C9H10FNO3S/c10-15(12,13)14-9-3-1-2-6-7(9)4-5-8(6)11/h1-3,8H,4-5,11H2/t8-/m1/s1
Definition date:	2023-03-10
Last modified:	2024-09-27
Release date:	2023-07-05
Identifier:	(1R)-1-amino-2,3-dihydro-1H-inden-4-yl sulfurofluoridate

NX6

NX6
Name:	N-[(benzyloxy)carbonyl]-L-aspartic acid
Formula:	C12 H13 N O6
SMILES:	O=C(O)C(NC(=O)OCc1ccccc1)CC(=O)O
InChi:	InChI=1S/C12H13NO6/c14-10(15)6-9(11(16)17)13-12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,18)(H,14,15)(H,16,17)/t9-/m0/s1
Definition date:	2011-01-26
Last modified:	2024-09-27
Identifier:	N-[(benzyloxy)carbonyl]-L-aspartic acid

ZHZ

ZHZ
Name:	2-(4-METHOXYPHENYL)ACETAMIDE
Formula:	C9 H11 N O2
SMILES:	O=C(N)Cc1ccc(OC)cc1
InChi:	InChI=1S/C9H11NO2/c1-12-8-4-2-7(3-5-8)6-9(10)11/h2-5H,6H2,1H3,(H2,10,11)
Definition date:	2006-10-27
Last modified:	2024-09-27
Identifier:	2-(4-methoxyphenyl)acetamide

NXA

NXA
Name:	N-CARBOXYALANINE
Formula:	C4 H7 N O4
SMILES:	O=C(O)C(NC(=O)O)C
InChi:	InChI=1S/C4H7NO4/c1-2(3(6)7)5-4(8)9/h2,5H,1H3,(H,6,7)(H,8,9)/t2-/m0/s1
Definition date:	2002-11-26
Last modified:	2024-09-27
Identifier:	N-carboxy-L-alanine

NXC

NXC
Name:	(2,6-bis[(dimethylamino-kappaN)methyl]-4-{3-[(S)-ethoxy(4-nitrophenoxy)phosphoryl]propyl}phenyl-kappaC~1~)(chloro)platinum(2+)
Formula:	C23 H33 Cl N3 O5 P Pt
SMILES:	CCO[P](=O)(CCCc1cc2CN(C)(C)\|[Pt]3(Cl)\|N(C)(C)Cc(c1)c23)Oc4ccc(cc4)[N+]([O-])=O
InChi:	InChI=1S/C23H33N3O5P.ClH.Pt/c1-6-30-32(29,31-23-11-9-22(10-12-23)26(27)28)13-7-8-19-14-20(17-24(2)3)16-21(15-19)18-25(4)5
Synonyms:	ethyl 4-nitrophenyl P-[3-(4-(chloroplatino)-1,3-bis > [(dimethylamino)methyl]-phenyl)propyl]phosphonate
Definition date:	2008-09-12
Last modified:	2024-09-27

FTR

FTR
Name:	FLUOROTRYPTOPHANE
Formula:	C11 H11 F N2 O2
SMILES:	O=C(O)C(N)Cc2c1cc(F)ccc1nc2
InChi:	InChI=1S/C11H11FN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	5-fluoro-L-tryptophan

1MH

1MH
Name:	3-pyridin-3-yl-L-alanine
Formula:	C8 H10 N2 O2
SMILES:	O=C(O)C(N)Cc1cccnc1
InChi:	InChI=1S/C8H10N2O2/c9-7(8(11)12)4-6-2-1-3-10-5-6/h1-3,5,7H,4,9H2,(H,11,12)/t7-/m0/s1
Definition date:	2013-03-28
Last modified:	2024-09-27
Release date:	2013-06-12
Identifier:	3-pyridin-3-yl-L-alanine

FTT

FTT
Name:	3-HYDROXY-TETRADECANOIC ACID
Formula:	C14 H28 O3
SMILES:	O=C(O)CC(O)CCCCCCCCCCC
InChi:	InChI=1S/C14H28O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h13,15H,2-12H2,1H3,(H,16,17)/t13-/m1/s1
Synonyms:	3-HYDROXY-MYRISTIC ACID
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(3R)-3-hydroxytetradecanoic acid

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