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OJO

OJO
Name:	1-{4-[(3-chloro-5-hydroxyphenyl)methyl]piperazin-1-yl}ethan-1-one
Formula:	C13 H17 Cl N2 O2
SMILES:	CC(=O)N1CCN(Cc2cc(Cl)cc(O)c2)CC1
InChi:	InChI=1S/C13H17ClN2O2/c1-10(17)16-4-2-15(3-5-16)9-11-6-12(14)8-13(18)7-11/h6-8,18H,2-5,9H2,1H3
Definition date:	2023-08-17
Last modified:	2024-09-27
Release date:	2023-11-08
Identifier:	1-{4-[(3-chloro-5-hydroxyphenyl)methyl]piperazin-1-yl}ethan-1-one

2MK

2MK
Name:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S)-1,2-dihydroxy-5-methylhexan-3-yl]-L-leucinamide
Formula:	C27 H45 N3 O6
SMILES:	O=C(NC(CC(C)C)C(O)CO)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C
InChi:	InChI=1S/C27H45N3O6/c1-17(2)12-21(24(32)15-31)28-25(33)22(13-18(3)4)29-26(34)23(14-19(5)6)30-27(35)36-16-20-10-8-7-9-11-20/h7-11,17-19,21-24,31-32H,12-16H2,1-6H3,(H,28,33)(H,29,34)(H,30,35)/t21-,22-,23-,24-/m0/s1
Synonyms:	PHQ-Leu-Leu-Leu-ketoaldehyde, bound form
Definition date:	2013-12-04
Last modified:	2024-09-27
Release date:	2014-02-12
Identifier:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S)-1,2-dihydroxy-5-methylhexan-3-yl]-L-leucinamide

2ML

2ML
Name:	2-METHYLLEUCINE
Formula:	C7 H15 N O2
SMILES:	O=C(O)C(N)(C)CC(C)C
InChi:	InChI=1S/C7H15NO2/c1-5(2)4-7(3,8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t7-/m0/s1
Definition date:	2001-02-08
Last modified:	2024-09-27
Identifier:	2-methyl-L-leucine

OJU

OJU
Name:	2-[[[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxyethyl-[3-(2-chloranylethanoylamino)propyl]-dimethyl-azanium
Formula:	C18 H33 Cl N5 O12 P2
SMILES:	C[N+](C)(CCCNC(=O)CCl)CCO[P](O)(=O)O[P](O)(=O)OCC1OC(C(O)C1O)N2C=CC(=NC2=O)N
InChi:	InChI=1S/C18H32ClN5O12P2/c1-24(2,7-3-5-21-14(25)10-19)8-9-33-37(29,30)36-38(31,32)34-11-12-15(26)16(27)17(35-12)23-6-4-13(20)22-18(23)28/h4,6,12,15-17,26-27H,3,5,7-11H2,1-2H3,(H4-,20,21,22,25,28,29,30,31,32)/p+1
Synonyms:	Cytidine-diphosphate with a thiol-reactive chloroacetamide (cross-linker)
Definition date:	2022-09-13
Last modified:	2024-09-27
Release date:	2023-04-12
Identifier:	2-[[[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxyethyl-[3-(2-chloranylethanoylamino)propyl]-dimethyl-azanium

2MM

2MM
Name:	N,N-dimethyl-L-methionine
Formula:	C7 H15 N O2 S
SMILES:	O=C(O)C(N(C)C)CCSC
InChi:	InChI=1S/C7H15NO2S/c1-8(2)6(7(9)10)4-5-11-3/h6H,4-5H2,1-3H3,(H,9,10)/t6-/m0/s1
Definition date:	2008-03-14
Last modified:	2024-09-27
Identifier:	N,N-dimethyl-L-methionine

2MR

2MR
Name:	N3, N4-DIMETHYLARGININE
Formula:	C8 H18 N4 O2
SMILES:	O=C(O)C(N)CCCNC(=N/C)NC
InChi:	InChI=1S/C8H18N4O2/c1-10-8(11-2)12-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H,13,14)(H2,10,11,12)/t6-/m0/s1
Definition date:	2000-11-03
Last modified:	2024-09-27
Identifier:	N~5~-(N,N'-dimethylcarbamimidoyl)-L-ornithine

2MT

2MT
Name:	(4R)-2,2-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID
Formula:	C6 H11 N O2 S
SMILES:	O=C(O)C1NC(SC1)(C)C
InChi:	InChI=1S/C6H11NO2S/c1-6(2)7-4(3-10-6)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1
Synonyms:	2,2-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID
Definition date:	2004-02-16
Last modified:	2024-09-27
Identifier:	(4R)-2,2-dimethyl-1,3-thiazolidine-4-carboxylic acid

OK3

OK3
Name:	(4~{R})-4-[[4-(aminomethyl)phenyl]carbonylamino]-3,3-bis(oxidanyl)-2-oxa-3-boranuidabicyclo[4.4.0]deca-1(10),6,8-triene-10-carboxylic acid
Formula:	C17 H18 B N2 O6
SMILES:	NCc1ccc(cc1)C(=O)N[CH]2Cc3cccc(C(O)=O)c3O[B-]2(O)O
InChi:	InChI=1S/C17H18BN2O6/c19-9-10-4-6-11(7-5-10)16(21)20-14-8-12-2-1-3-13(17(22)23)15(12)26-18(14,24)25/h1-7,14,24-25H,8-9,19H2,(H,20,21)(H,22,23)/q-1/t14-/m0/s1
Definition date:	2015-12-08
Last modified:	2024-09-27
Release date:	2016-08-10
Identifier:	(4~{R})-4-[[4-(aminomethyl)phenyl]carbonylamino]-3,3-bis(oxidanyl)-2-oxa-3-boranuidabicyclo[4.4.0]deca-1(10),6,8-triene-10-carboxylic acid

OK9

OK9
Name:	N-{(1Z)-1-[5-(morpholin-4-yl)thiophen-2-yl]-3-oxoprop-1-en-2-yl}thiophene-2-carboxamide
Formula:	C16 H16 N2 O3 S2
SMILES:	O=CC(NC(=O)c1cccs1)=Cc1ccc(s1)N1CCOCC1
InChi:	InChI=1S/C16H16N2O3S2/c19-11-12(17-16(20)14-2-1-9-22-14)10-13-3-4-15(23-13)18-5-7-21-8-6-18/h1-4,9-11H,5-8H2,(H,17,20)/b12-10-
Definition date:	2023-08-17
Last modified:	2024-09-27
Release date:	2023-11-08
Identifier:	N-{(1Z)-1-[5-(morpholin-4-yl)thiophen-2-yl]-3-oxoprop-1-en-2-yl}thiophene-2-carboxamide

2N2

2N2
Name:	2-(3,6-dihydroxy-9H-xanthen-9-yl)-5-{[(6-oxohexyl)carbamothioyl]amino}benzoic acid
Formula:	C27 H26 N2 O7 S
SMILES:	O=CCCCCCNC(=S)Nc1ccc(c(C(=O)O)c1)C3c4c(Oc2c3ccc(O)c2)cc(O)cc4
InChi:	InChI=1S/C27H26N2O7S/c30-16-6-9-19-22(13-16)36-23-14-17(31)7-10-20(23)25(19)18-8-5-15(12-21(18)26(34)35)29-27(37)28-11-3-1-2-4-24(32)33/h5-10,12-14,25,30-31H,1-4,11H2,(H,32,33)(H,34,35)(H2,28,29,37)
Definition date:	2013-12-05
Last modified:	2024-09-27
Release date:	2014-02-26
Identifier:	2-(3,6-dihydroxy-9H-xanthen-9-yl)-5-{[(6-oxohexyl)carbamothioyl]amino}benzoic acid

2NF

2NF
Name:	[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1yl)- 3-fluoro-,4- hydroxyoxolan-2-yl]methyl phosphate
Formula:	C21 H26 F N7 O13 P2
SMILES:	NC(=O)c1ccc[n+](c1)[CH]2O[CH](CO[P]([O-])(=O)O[P](O)(=O)OC[CH]3O[CH]([CH](O)[CH]3O)n4cnc5c(N)ncnc45)[CH](O)[CH]2F
InChi:	InChI=1S/C21H26FN7O13P2/c22-12-14(30)10(40-20(12)28-3-1-2-9(4-28)18(24)33)5-38-43(34,35)42-44(36,37)39-6-11-15(31)16(32)21(41-11)29-8-27-13-17(23)25-7-26-19(13)29/h1-4,7-8,10-12,14-16,20-21,30-32H,5-6H2,(H5-,23,24,25,26,33,34,35,36,37)/t10-,11-,12-,14-,15-,16-,20-,21-/m1/s1
Synonyms:	nicotinamide 2'-deoxy-2'-fluororibofuranosyl adenine dinucleotide
Definition date:	2009-03-27
Last modified:	2024-09-27
Identifier:	[(2R,3R,4R,5R)-5-(3-aminocarbonylpyridin-1-ium-1-yl)-4-fluoro-3-hydroxy-oxolan-2-yl]methyl [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphate

2NO

2NO
Name:	NITROGEN DIOXIDE
Formula:	N O2
SMILES:	ON=O
InChi:	InChI=1S/HNO2/c2-1-3/h(H,2,3)
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	nitrous acid

OL1

OL1
Name:	7-phenyl-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)heptane-1,1-diol
Formula:	C21 H24 N2 O3
SMILES:	n3c(c1oc(nc1)C(O)(O)CCCCCCc2ccccc2)cccc3
InChi:	InChI=1S/C21H24N2O3/c24-21(25,14-8-2-1-4-10-17-11-5-3-6-12-17)20-23-16-19(26-20)18-13-7-9-15-22-18/h3,5-7,9,11-13,15-16,24-25H,1-2,4,8,10,14H2
Definition date:	2009-05-19
Last modified:	2024-09-27
Identifier:	7-phenyl-1-(5-pyridin-2-yl-1,3-oxazol-2-yl)heptane-1,1-diol

OLA

OLA
Name:	OLEIC ACID
Formula:	C18 H34 O2
SMILES:	O=C(O)CCCCCCCC=C/CCCCCCCC
InChi:	InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(9Z)-octadec-9-enoic acid

OLD

OLD
Name:	3-[2-(4-bromophenyl)-2-oxoethyl]-L-histidine
Formula:	C14 H14 Br N3 O3
SMILES:	O=C(c1ccc(Br)cc1)Cn2c(cnc2)CC(C(=O)O)N
InChi:	InChI=1S/C14H14BrN3O3/c15-10-3-1-9(2-4-10)13(19)7-18-8-17-6-11(18)5-12(16)14(20)21/h1-4,6,8,12H,5,7,16H2,(H,20,21)/t12-/m0/s1
Definition date:	2009-06-26
Last modified:	2024-09-27
Release date:	2012-10-12
Identifier:	3-[2-(4-bromophenyl)-2-oxoethyl]-L-histidine

OLT

OLT
Name:	O-METHYL-L-THREONINE
Formula:	C5 H11 N O3
SMILES:	O=C(O)C(N)C(OC)C
InChi:	InChI=1S/C5H11NO3/c1-3(9-2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t3-,4+/m1/s1
Definition date:	2005-09-02
Last modified:	2024-09-27
Identifier:	O-methyl-L-threonine

2ON

2ON
Name:	2-sulfanyl-1,9-dihydro-6H-purin-6-one
Formula:	C5 H4 N4 O S
SMILES:	O=C1c2ncnc2N=C(S)N1
InChi:	InChI=1S/C5H4N4OS/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
Definition date:	2014-04-23
Last modified:	2024-09-27
Release date:	2015-04-01
Identifier:	2-sulfanyl-1,9-dihydro-6H-purin-6-one

OLX

OLX
Name:	[(3R)-5-ethyl-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl]acetic acid
Formula:	C12 H13 N O4
SMILES:	O=C(O)CN1c2ccc(cc2C(O)C1=O)CC
InChi:	InChI=1S/C12H13NO4/c1-2-7-3-4-9-8(5-7)11(16)12(17)13(9)6-10(14)15/h3-5,11,16H,2,6H2,1H3,(H,14,15)/t11-/m1/s1
Definition date:	2023-08-17
Last modified:	2024-09-27
Release date:	2023-11-08
Identifier:	[(3R)-5-ethyl-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl]acetic acid

2OP

2OP
Name:	(2S)-2-HYDROXYPROPANOIC ACID
Formula:	C3 H6 O3
SMILES:	O=C(O)C(O)C
InChi:	InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1
Definition date:	2004-12-29
Last modified:	2024-09-27
Identifier:	(2S)-2-hydroxypropanoic acid

OM0

OM0
Name:	(1R,2S,3R,4R)-5-bromo-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol
Formula:	C7 H11 Br O5
SMILES:	OC1C(CO)=C(Br)C(O)C(O)C1O
InChi:	InChI=1S/C7H11BrO5/c8-3-2(1-9)4(10)6(12)7(13)5(3)11/h4-7,9-13H,1H2/t4-,5+,6+,7+/m1/s1
Synonyms:	C5a-bromo-valienide
Definition date:	2022-05-12
Last modified:	2024-09-27
Release date:	2023-04-05
Identifier:	(1R,2S,3R,4R)-5-bromo-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol

2OR

2OR
Name:	amino{[(2R,3R,4S)-4-amino-2,3,5-trihydroxy-5-oxopentyl]amino}methaniminium
Formula:	C6 H15 N4 O4
SMILES:	O=C(O)C(N)C(O)C(O)CNC(=[NH2+])N
InChi:	InChI=1S/C6H14N4O4/c7-3(5(13)14)4(12)2(11)1-10-6(8)9/h2-4,11-12H,1,7H2,(H,13,14)(H4,8,9,10)/p+1/t2-,3+,4+/m1/s1
Definition date:	2013-08-28
Last modified:	2024-09-27
Release date:	2014-06-25
Identifier:	amino{[(2R,3R,4S)-4-amino-2,3,5-trihydroxy-5-oxopentyl]amino}methaniminium

2OY

2OY
Name:	N-[(2S,3S)-7-amino-1-chloro-2-hydroxyheptan-3-yl]-4-methylbenzenesulfonamide (Bound Form)
Formula:	C14 H23 Cl N2 O3 S
SMILES:	O=S(=O)(NC(CCCCN)C(O)CCl)c1ccc(cc1)C
InChi:	InChI=1S/C14H23ClN2O3S/c1-11-5-7-12(8-6-11)21(19,20)17-13(14(18)10-15)4-2-3-9-16/h5-8,13-14,17-18H,2-4,9-10,16H2,1H3/t13-,14+/m0/s1
Synonyms:	Tosyllysine Chloromethyl Ketone (Bound Form)
Definition date:	2013-12-19
Last modified:	2024-09-27
Release date:	2014-04-23
Identifier:	N-[(2S,3S)-7-amino-1-chloro-2-hydroxyheptan-3-yl]-4-methylbenzenesulfonamide

OMC

OMC
Name:	O2'-METHYLYCYTIDINE-5'-MONOPHOSPHATE
Formula:	C10 H16 N3 O8 P
SMILES:	O=C1N=C(N)C=CN1C2OC(C(O)C2OC)COP(=O)(O)O
InChi:	InChI=1S/C10H16N3O8P/c1-19-8-7(14)5(4-20-22(16,17)18)21-9(8)13-3-2-6(11)12-10(13)15/h2-3,5,7-9,14H,4H2,1H3,(H2,11,12,15)(H2,16,17,18)/t5-,7-,8-,9-/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	2'-O-methylcytidine 5'-(dihydrogen phosphate)

2P2

2P2
Name:	1-[(2R,5S)-2-tert-butyl-5-({(2S)-2-[(1R)-1,2-dihydroxyethyl]pyrrolidin-1-yl}carbonyl)pyrrolidin-1-yl]-4-phenylbutan-1-one
Formula:	C25 H38 N2 O4
SMILES:	O=C(N2C(C(=O)N1C(C(O)CO)CCC1)CCC2C(C)(C)C)CCCc3ccccc3
InChi:	InChI=1S/C25H38N2O4/c1-25(2,3)22-15-14-20(24(31)26-16-8-12-19(26)21(29)17-28)27(22)23(30)13-7-11-18-9-5-4-6-10-18/h4-6,9-10,19-22,28-29H,7-8,11-17H2,1-3H3/t19-,20-,21-,22+/m0/s1
Definition date:	2012-03-15
Last modified:	2024-09-27
Identifier:	(1R)-1-{(2S)-1-[(5R)-5-tert-butyl-1-(4-phenylbutanoyl)-L-prolyl]pyrrolidin-2-yl}ethane-1,2-diol

2P3

2P3
Name:	5-[(2S)-2,3-dihydro-1,4-benzodioxin-2-yl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Formula:	C10 H9 N3 O2 S
SMILES:	S=C1NN=C(N1)C2Oc3ccccc3OC2
InChi:	InChI=1S/C10H9N3O2S/c16-10-11-9(12-13-10)8-5-14-6-3-1-2-4-7(6)15-8/h1-4,8H,5H2,(H2,11,12,13,16)/t8-/m1/s1
Definition date:	2013-12-23
Last modified:	2024-09-27
Release date:	2014-08-20
Identifier:	5-[(2S)-2,3-dihydro-1,4-benzodioxin-2-yl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

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