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8AN

8AN
Name:	3'-amino-3'-deoxyadenosine 5'-(dihydrogen phosphate)
Formula:	C10 H15 N6 O6 P
SMILES:	O=P(O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3N
InChi:	InChI=1S/C10H15N6O6P/c11-5-4(1-21-23(18,19)20)22-10(7(5)17)16-3-15-6-8(12)13-2-14-9(6)16/h2-5,7,10,17H,1,11H2,(H2,12,13,14)(H2,18,19,20)/t4-,5-,7-,10-/m1/s1
Definition date:	2008-03-27
Last modified:	2024-09-27
Identifier:	3'-amino-3'-deoxyadenosine 5'-(dihydrogen phosphate)

LBV

LBV
Name:	3-[2-[(Z)-[3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-4-methyl-pyrrol-1-ium -2-ylidene]methyl]-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxidanylidene-pyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-3- yl]propanoic acid
Formula:	C33 H37 N4 O6
SMILES:	CC=C1[CH](C)C(=O)NC1=Cc2[nH]c(C=C3[NH+]=C(C=C4NC(=O)C(=C4C)C=C)C(=C3CCC(O)=O)C)c(CCC(O)=O)c2C
InChi:	InChI=1S/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-15,19,35H,2,9-12H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p+1/b20-7+,26-13-,27-14-,28-15-/t19-/m0/s1
Synonyms:	2(R),3(E)- PHYTOCHROMOBILIN
Definition date:	2006-12-22
Last modified:	2024-09-27
Identifier:	3-[2-[(Z)-[3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-4-methyl-pyrrol-1-ium-2-ylidene]methyl]-5-[(Z)-[(3E)-3-ethylidene-4-methyl-5-oxidanylidene-pyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid

LBW

LBW
Name:	3-[2-[(Z)-[5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-3-(3-hydroxy-3-oxopropyl)-4-methyl-pyrrol-1-ium-2-ylidene]methyl]-5-[(Z)-[(3E,4R)-3-ethylidene-4-methyl-5-oxidanylidene-pyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid
Formula:	C33 H37 N4 O6
SMILES:	CC=C1[CH](C)C(=O)NC1=Cc2[nH]c(C=C3[NH+]=C(C=C4NC(=O)C(=C4C)C=C)C(=C3CCC(O)=O)C)c(CCC(O)=O)c2C
InChi:	InChI=1S/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-15,19,35H,2,9-12H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p+1/b20-7+,26-13-,27-14-,28-15-/t19-/m1/s1
Definition date:	2011-12-31
Last modified:	2024-09-27
Identifier:	3-[2-[(Z)-[5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-3-(3-hydroxy-3-oxopropyl)-4-methyl-pyrrol-1-ium-2-ylidene]methyl]-5-[(Z)-[(3E,4R)-3-ethylidene-4-methyl-5-oxidanylidene-pyrrolidin-2-ylidene]methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid

LBX

LBX
Name:	(E)-5-hydroxy-3-oxo-N-(3-oxopropylidene)-L-norvaline
Formula:	C8 H11 N O5
SMILES:	O=C(CCO)C(N=CCC=O)C(=O)O
InChi:	InChI=1S/C8H11NO5/c10-4-1-3-9-7(8(13)14)6(12)2-5-11/h3-4,7,11H,1-2,5H2,(H,13,14)/b9-3+/t7-/m0/s1
Definition date:	2022-03-01
Last modified:	2024-09-27
Release date:	2022-05-25
Identifier:	(E)-5-hydroxy-3-oxo-N-(3-oxopropylidene)-L-norvaline

LBZ

LBZ
Name:	(2~{S})-2-azanyl-6-benzamido-hexanoic acid
Formula:	C13 H18 N2 O3
SMILES:	N[CH](CCCCNC(=O)c1ccccc1)C(O)=O
InChi:	InChI=1S/C13H18N2O3/c14-11(13(17)18)8-4-5-9-15-12(16)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9,14H2,(H,15,16)(H,17,18)/t11-/m0/s1
Definition date:	2020-01-22
Last modified:	2024-09-27
Release date:	2020-11-18
Identifier:	(2~{S})-2-azanyl-6-benzamido-hexanoic acid

8B9

8B9
Name:	2-acetamido-2,4-dideoxy-alpha-D-xylo-hexopyranose
Formula:	C8 H15 N O5
SMILES:	CC(=O)N[CH]1[CH](O)C[CH](CO)O[CH]1O
InChi:	InChI=1S/C8H15NO5/c1-4(11)9-7-6(12)2-5(3-10)14-8(7)13/h5-8,10,12-13H,2-3H2,1H3,(H,9,11)/t5-,6-,7+,8-/m0/s1
Synonyms:	N-[(2S,3R,4S,6S)-6-(hydroxymethyl)-2,4-bis(oxidanyl)oxan-3-yl]ethanamide
Definition date:	2017-06-02
Last modified:	2024-09-27
Release date:	2017-10-25
Identifier:	~{N}-[(2~{S},3~{R},4~{S},6~{S})-6-(hydroxymethyl)-2,4-bis(oxidanyl)oxan-3-yl]ethanamide

8BB

8BB
Name:	trans-4-{[(E)-1-amino-2-sulfanylethenyl]carbamoyl}cyclohexanecarboxylic acid
Formula:	C10 H16 N2 O3 S
SMILES:	O=C(O)C1CCC(C(=O)NC(=CS)N)CC1
InChi:	InChI=1S/C10H16N2O3S/c11-8(5-16)12-9(13)6-1-3-7(4-2-6)10(14)15/h5-7,16H,1-4,11H2,(H,12,13)(H,14,15)/b8-5+/t6-,7-
Definition date:	2012-01-04
Last modified:	2024-09-27
Identifier:	trans-4-{[(E)-1-amino-2-sulfanylethenyl]carbamoyl}cyclohexanecarboxylic acid

LCE

LCE
Name:	(1S,3S,4S,5S)-7,7-dichloro-3-methoxy-2-thiabicyclo[3.2.0]heptan-6-one-4-carboxylic acid
Formula:	C8 H8 Cl2 O4 S
SMILES:	O=C(O)C1C2C(=O)C(Cl)(Cl)C2SC1OC
InChi:	InChI=1S/C8H8Cl2O4S/c1-14-7-3(6(12)13)2-4(11)8(9,10)5(2)15-7/h2-3,5,7H,1H3,(H,12,13)/t2-,3-,5-,7-/m0/s1
Synonyms:	(1S,3S,4S,5S)-7,7-dichloro-3-methoxy-6-oxo-2-thiabicyclo[3.2.0]heptane-4-carboxylic acid
Definition date:	2010-02-15
Last modified:	2024-09-27
Identifier:	(1S,3S,4S,5S)-7,7-dichloro-3-methoxy-6-oxo-2-thiabicyclo[3.2.0]heptane-4-carboxylic acid

LCK

LCK
Name:	(Z)-N~6~-(2-carboxy-1-methylethylidene)-L-lysine
Formula:	C10 H18 N2 O4
SMILES:	O=C(O)CC(=N/CCCCC(N)C(=O)O)C
InChi:	InChI=1S/C10H18N2O4/c1-7(6-9(13)14)12-5-3-2-4-8(11)10(15)16/h8H,2-6,11H2,1H3,(H,13,14)(H,15,16)/b12-7-/t8-/m0/s1
Definition date:	2008-02-15
Last modified:	2024-09-27
Identifier:	(Z)-N~6~-(2-carboxy-1-methylethylidene)-L-lysine

8BP

8BP
Name:	N-[(3R,4R)-4-fluoro-1-{6-[(1-methyl-1H-pyrazol-4-yl)amino]-9-(propan-2-yl)-9H-purin-2-yl}pyrrolidin-3-yl]propanamide
Formula:	C19 H26 F N9 O
SMILES:	C1C(NC(CC)=O)C(CN1c3nc(Nc2cn(C)nc2)c4c(n3)n(cn4)C(C)C)F
InChi:	InChI=1S/C19H26FN9O/c1-5-15(30)24-14-9-28(8-13(14)20)19-25-17(23-12-6-22-27(4)7-12)16-18(26-19)29(10-21-16)11(2)3/h6-7,10-11,13-14H,5,8-9H2,1-4H3,(H,24,30)(H,23,25,26)/t13-,14-/m1/s1
Definition date:	2017-01-17
Last modified:	2024-09-27
Release date:	2017-03-22
Identifier:	N-[(3R,4R)-4-fluoro-1-{6-[(1-methyl-1H-pyrazol-4-yl)amino]-9-(propan-2-yl)-9H-purin-2-yl}pyrrolidin-3-yl]propanamide

8BS

8BS
Name:	N-[(3R,4R)-4-fluoro-1-{6-[(3-methoxy-1-methyl-1H-pyrazol-4-yl)amino]-9-methyl-9H-purin-2-yl}pyrrolidin-3-yl]propanamide
Formula:	C18 H24 F N9 O2
SMILES:	C1C(NC(CC)=O)C(CN1c3nc(Nc2cn(C)nc2OC)c4c(n3)n(cn4)C)F
InChi:	InChI=1S/C18H24FN9O2/c1-5-13(29)21-11-8-28(6-10(11)19)18-23-15(14-16(24-18)26(2)9-20-14)22-12-7-27(3)25-17(12)30-4/h7,9-11H,5-6,8H2,1-4H3,(H,21,29)(H,22,23,24)/t10-,11-/m1/s1
Definition date:	2017-01-17
Last modified:	2024-09-27
Release date:	2017-03-22
Identifier:	N-[(3R,4R)-4-fluoro-1-{6-[(3-methoxy-1-methyl-1H-pyrazol-4-yl)amino]-9-methyl-9H-purin-2-yl}pyrrolidin-3-yl]propanamide

LCW

LCW
Name:	2-[4-[(6-ethenyl-9~{H}-purin-2-yl)amino]phenyl]ethanamide
Formula:	C15 H14 N6 O
SMILES:	NC(=O)Cc1ccc(Nc2nc3[nH]cnc3c(C=C)n2)cc1
InChi:	InChI=1S/C15H14N6O/c1-2-11-13-14(18-8-17-13)21-15(20-11)19-10-5-3-9(4-6-10)7-12(16)22/h2-6,8H,1,7H2,(H2,16,22)(H2,17,18,19,20,21)
Definition date:	2019-08-05
Last modified:	2024-09-27
Release date:	2020-06-17
Identifier:	2-[4-[(6-ethenyl-9~{H}-purin-2-yl)amino]phenyl]ethanamide

LCY

LCY
Name:	1-methylpyrrolidine-2,5-dione
Formula:	C5 H7 N O2
SMILES:	O=C1N(C(=O)CC1)C
InChi:	InChI=1S/C5H7NO2/c1-6-4(7)2-3-5(6)8/h2-3H2,1H3
Definition date:	2009-05-22
Last modified:	2024-09-27
Identifier:	1-methylpyrrolidine-2,5-dione

LD0

LD0
Name:	(2R,4S,5R)-2-[(1R)-1-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-2-oxoethyl]-5-(sulfanylmethyl)-1,3-thiazinane-4-carboxylic acid
Formula:	C14 H19 N5 O5 S3
SMILES:	SCC1CSC(NC1C(=O)O)C(C=O)NC(=O)C(=NOC)/c1csc(N)n1
InChi:	InChI=1S/C14H19N5O5S3/c1-24-19-10(8-5-27-14(15)17-8)11(21)16-7(2-20)12-18-9(13(22)23)6(3-25)4-26-12/h2,5-7,9,12,18,25H,3-4H2,1H3,(H2,15,17)(H,16,21)(H,22,23)/b19-10-/t6-,7-,9+,12-/m1/s1
Definition date:	2022-03-01
Last modified:	2024-09-27
Release date:	2022-05-25
Identifier:	(2R,4S,5R)-2-[(1R)-1-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-2-oxoethyl]-5-(sulfanylmethyl)-1,3-thiazinane-4-carboxylic acid

LDH

LDH
Name:	N~6~-ETHYL-L-LYSINE
Formula:	C8 H18 N2 O2
SMILES:	O=C(O)C(N)CCCCNCC
InChi:	InChI=1S/C8H18N2O2/c1-2-10-6-4-3-5-7(9)8(11)12/h7,10H,2-6,9H2,1H3,(H,11,12)/t7-/m0/s1
Definition date:	2007-07-09
Last modified:	2024-09-27
Identifier:	N~6~-ethyl-L-lysine

LDO

LDO
Name:	6-HYDROXY-L-NORLEUCINE
Formula:	C6 H13 N O3
SMILES:	O=C(O)C(N)CCCCO
InChi:	InChI=1S/C6H13NO3/c7-5(6(9)10)3-1-2-4-8/h5,8H,1-4,7H2,(H,9,10)/t5-/m0/s1
Definition date:	2001-09-11
Last modified:	2024-09-27
Identifier:	6-hydroxy-L-norleucine

8CY

8CY
Name:	ruthenocenyl-7-aminodesacetoxycephalosporanic acid, bound form
Formula:	C22 H15 N2 O6 Ru S
SMILES:	C%12SC(C(C(=O)O)NC(=O)CCC(C9%10C8C7C%11[Ru]6432789(C1C5C4C3C12)C%10%11)=O)NC(=C%12C)C(=O)O
InChi:	InChI=1S/C17H19N2O6S.C5H5.Ru/c1-9-8-26-15(19-13(9)16(22)23)14(17(24)25)18-12(21)7-6-11(20)10-4-2-3-5-10
Definition date:	2017-01-19
Last modified:	2024-09-27
Release date:	2017-02-08
Identifier:	[(1,2,3,4,5-eta)-1-(4-{[carboxy(4-carboxy-5-methyl-3,6-dihydro-2H-1,3-thiazin-2-yl)methyl]amino}-4-oxobutanoyl)cyclopentadienyl][(1,2,3,4,5-eta)-cyclopentadienyl]ruthenium

LE1

LE1
Name:	3-sulfanyl-L-valine
Formula:	C5 H11 N O2 S
SMILES:	O=C(O)C(N)C(S)(C)C
InChi:	InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m1/s1
Synonyms:	L-LE1ICILLAMINE
Definition date:	2009-05-15
Last modified:	2024-09-27
Identifier:	3-sulfanyl-L-valine

LE2

LE2
Name:	N-(2-phenylethyl)thioformamide
Formula:	C9 H11 N S
SMILES:	S=CNCCc1ccccc1
InChi:	InChI=1S/C9H11NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,10,11)
Synonyms:	Phenylethyl isothiocyanate, bound form
Definition date:	2011-07-08
Last modified:	2024-09-27
Identifier:	N-(2-phenylethyl)thioformamide

LE3

LE3
Name:	N-{4-[(R)-methylsulfinyl]butyl}thioformamide
Formula:	C6 H13 N O S2
SMILES:	O=S(CCCCNC=S)C
InChi:	InChI=1S/C6H13NOS2/c1-10(8)5-3-2-4-7-6-9/h6H,2-5H2,1H3,(H,7,9)/t10-/m1/s1
Synonyms:	L-Sulforaphane, bound form
Definition date:	2011-07-08
Last modified:	2024-09-27
Release date:	2012-09-28
Identifier:	N-{4-[(R)-methylsulfinyl]butyl}thioformamide

LEA

LEA
Name:	PENTANOIC ACID
Formula:	C5 H10 O2
SMILES:	O=C(O)CCCC
InChi:	InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)
Synonyms:	VALERIC ACID
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	pentanoic acid

LED

LED
Name:	(4R)-5-OXO-L-LEUCINE
Formula:	C6 H11 N O3
SMILES:	O=CC(C)CC(N)C(=O)O
InChi:	InChI=1S/C6H11NO3/c1-4(3-8)2-5(7)6(9)10/h3-5H,2,7H2,1H3,(H,9,10)/t4-,5+/m1/s1
Definition date:	2006-06-07
Last modified:	2024-09-27
Identifier:	(4R)-5-oxo-L-leucine

LEF

LEF
Name:	(4S)-5-FLUORO-L-LEUCINE
Formula:	C6 H12 F N O2
SMILES:	FCC(CC(N)C(=O)O)C
InChi:	InChI=1S/C6H12FNO2/c1-4(3-7)2-5(8)6(9)10/h4-5H,2-3,8H2,1H3,(H,9,10)/t4-,5-/m0/s1
Definition date:	2003-05-13
Last modified:	2024-09-27
Identifier:	(4S)-5-fluoro-L-leucine

8DN

8DN
Name:	1-(3,5-dimethylphenyl)-4-methyl-1H-1,2,3-triazole
Formula:	C11 H13 N3
SMILES:	Cc1cc(C)cc(c1)n1cc(C)nn1
InChi:	InChI=1S/C11H13N3/c1-8-4-9(2)6-11(5-8)14-7-10(3)12-13-14/h4-7H,1-3H3
Definition date:	2021-09-14
Last modified:	2024-09-27
Release date:	2021-11-03
Identifier:	1-(3,5-dimethylphenyl)-4-methyl-1H-1,2,3-triazole

LEI

LEI
Name:	3-sulfanyl-D-valine
Formula:	C5 H11 N O2 S
SMILES:	O=C(O)C(N)C(S)(C)C
InChi:	InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m0/s1
Synonyms:	D-PENICILLAMINE
Definition date:	2009-05-16
Last modified:	2024-09-27
Identifier:	3-sulfanyl-D-valine

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