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OBZ

OBZ
Name:	O-benzylhydroxylamine
Formula:	C7 H9 N O
SMILES:	[(aminooxy)methyl]benzene
InChi:	InChI=1S/C7H9NO/c8-9-6-7-4-2-1-3-5-7/h1-5H,6,8H2
Definition date:	2008-07-23
Last modified:	2011-06-04
Identifier:	O-benzylhydroxylamine

2OM

2OM
Name:	5,6-dihydroorotidine 5'-monophosphate
Formula:	C10 H15 N2 O11 P
SMILES:	O=C(O)C1N(C(=O)NC(=O)C1)C2OC(C(O)C2O)COP(=O)(O)O
InChi:	InChI=1S/C10H15N2O11P/c13-5-1-3(9(16)17)12(10(18)11-5)8-7(15)6(14)4(23-8)2-22-24(19,20)21/h3-4,6-8,14-15H,1-2H2,(H,16,17)(H,11,13,18)(H2,19,20,21)/t3-,4-,6-,7-,8-/m1/s1
Definition date:	2009-02-06
Last modified:	2011-06-04
Identifier:	6-carboxyuridine 5'-(dihydrogen phosphate)

OC9

OC9
Name:	OCTAN-1-OL
Formula:	C8 H18 O
SMILES:	OCCCCCCCC
InChi:	InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
Definition date:	2005-05-16
Last modified:	2011-06-04
Identifier:	octan-1-ol

2OT

2OT
Name:	2'-O-[2-(N,N-DIMETHYLAMINOOXY)ETHYL] THYMIDINE-5'-MONOPHOSPHATE
Formula:	C14 H24 N3 O10 P
SMILES:	O=C1NC(=O)N(C=C1C)C2OC(C(O)C2OCCON(C)C)COP(=O)(O)O
InChi:	InChI=1S/C14H24N3O10P/c1-8-6-17(14(20)15-12(8)19)13-11(24-4-5-25-16(2)3)10(18)9(27-13)7-26-28(21,22)23/h6,9-11,13,18H,4-5,7H2,1-3H3,(H,15,19,20)(H2,21,22,23)/t9-,10-,11-,13-/m1/s1
Definition date:	2004-12-21
Last modified:	2011-06-04
Identifier:	2'-O-{2-[(dimethylamino)oxy]ethyl}-5-methyluridine 5'-(dihydrogen phosphate)

OCG

OCG
Name:	5-amino-N-[5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl]-1-phenyl-1H-pyrazole-4-carboxamide
Formula:	C21 H18 N6 O3
SMILES:	O=C(c3ccc(c(NC(=O)c1c(N)n(nc1)c2ccccc2)c3)C)Nc4nocc4
InChi:	InChI=1S/C21H18N6O3/c1-13-7-8-14(20(28)25-18-9-10-30-26-18)11-17(13)24-21(29)16-12-23-27(19(16)22)15-5-3-2-4-6-15/h2-12H,22H2,1H3,(H,24,29)(H,25,26,28)
Definition date:	2010-08-12
Last modified:	2011-06-04
Identifier:	5-amino-N-[2-methyl-5-(1,2-oxazol-3-ylcarbamoyl)phenyl]-1-phenyl-1H-pyrazole-4-carboxamide

2PA

2PA
Name:	DIAMIDOPHOSPHATE
Formula:	H5 N2 O2 P
SMILES:	O=P(O)(N)N
InChi:	InChI=1S/H5N2O2P/c1-5(2,3)4/h(H5,1,2,3,4)
Definition date:	1999-07-29
Last modified:	2011-06-04
Identifier:	phosphorodiamidic acid

2PC

2PC
Name:	3,4-DIHYDRO-2H-PYRROLIUM-5-CARBOXYLATE
Formula:	C5 H7 N O2
SMILES:	[O-]C(=O)C1=[NH+]CCC1
InChi:	InChI=1S/C5H7NO2/c7-5(8)4-2-1-3-6-4/h1-3H2,(H,7,8)
Definition date:	2000-05-15
Last modified:	2011-06-04
Identifier:	3,4-dihydro-2H-pyrrolium-5-carboxylate

2PE

2PE
Name:	NONAETHYLENE GLYCOL
Formula:	C18 H38 O10
SMILES:	O(CCOCCOCCO)CCOCCOCCOCCOCCOCCO
InChi:	InChI=1S/C18H38O10/c19-1-3-21-5-7-23-9-11-25-13-15-27-17-18-28-16-14-26-12-10-24-8-6-22-4-2-20/h19-20H,1-18H2
Definition date:	1999-07-09
Last modified:	2011-06-04
Identifier:	3,6,9,12,15,18,21,24-octaoxahexacosane-1,26-diol

2PG

2PG
Name:	2-PHOSPHOGLYCERIC ACID
Formula:	C3 H7 O7 P
SMILES:	O=P(O)(O)OC(C(=O)O)CO
InChi:	InChI=1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	(2R)-3-hydroxy-2-(phosphonooxy)propanoic acid

2PH

2PH
Name:	[7,8-DIHYDRO-PTERIN-6-YL METHANYL]-PHOSPHONOPHOSPHATE
Formula:	C7 H11 N5 O8 P2
SMILES:	O=P(O)(O)OP(=O)(O)OCC1=NC=2C(=O)NC(=NC=2NC1)N
InChi:	InChI=1S/C7H11N5O8P2/c8-7-11-5-4(6(13)12-7)10-3(1-9-5)2-19-22(17,18)20-21(14,15)16/h1-2H2,(H,17,18)(H2,14,15,16)(H4,8,9,11,12,13)
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl trihydrogen diphosphate

2PN

2PN
Name:	IMIDODIPHOSPHORIC ACID
Formula:	H5 N O6 P2
SMILES:	O=P(O)(O)NP(=O)(O)O
InChi:	InChI=1S/H5NO6P2/c2-8(3,4)1-9(5,6)7/h(H5,1,2,3,4,5,6,7)
Definition date:	2006-06-15
Last modified:	2011-06-04
Identifier:	imidodiphosphoric acid

2PO

2PO
Name:	PHOSPHONATE
Formula:	H O3 P
SMILES:	[O-]P([O-])=O
InChi:	InChI=1S/H3O3P/c1-4(2)3/h4H,(H2,1,2,3)/p-2
Definition date:	2003-05-08
Last modified:	2011-06-04
Identifier:	phosphonate

2PQ

2PQ
Name:	2-[(1-{3-[4-(biphenyl-4-ylcarbonyl)-2-propylphenoxy]propyl}-1,2,3,4-tetrahydroquinolin-5-yl)oxy]-2-methylpropanoic acid
Formula:	C38 H41 N O5
SMILES:	O=C(O)C(Oc1cccc2c1CCCN2CCCOc5ccc(C(=O)c4ccc(c3ccccc3)cc4)cc5CCC)(C)C
InChi:	InChI=1S/C38H41NO5/c1-4-11-30-26-31(36(40)29-19-17-28(18-20-29)27-12-6-5-7-13-27)21-22-34(30)43-25-10-24-39-23-9-14-32-33(39)15-8-16-35(32)44-38(2,3)37(41)42/h5-8,12-13,15-22,26H,4,9-11,14,23-25H2,1-3H3,(H,41,42)
Definition date:	2009-02-23
Last modified:	2011-06-04
Identifier:	2-[(1-{3-[4-(biphenyl-4-ylcarbonyl)-2-propylphenoxy]propyl}-1,2,3,4-tetrahydroquinolin-5-yl)oxy]-2-methylpropanoic acid

ODE

ODE
Name:	DIETHYL (1R,2S,3R,4S)-5,6-BIS(4-HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT-5-ENE-2,3-DICARBOXYLATE
Formula:	C24 H24 O7
SMILES:	O=C(OCC)C4C(C(=O)OCC)C3OC4C(c1ccc(O)cc1)=C3c2ccc(O)cc2
InChi:	InChI=1S/C24H24O7/c1-3-29-23(27)19-20(24(28)30-4-2)22-18(14-7-11-16(26)12-8-14)17(21(19)31-22)13-5-9-15(25)10-6-13/h5-12,19-22,25-26H,3-4H2,1-2H3/t19-,20+,21-,22+
Definition date:	2007-07-11
Last modified:	2011-06-04
Identifier:	diethyl (1R,2S,3R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate

2PY

2PY
Name:	(2S)-1-{[5-(1H-INDAZOL-5-YL)PYRIDIN-3-YL]OXY}-3-[(7AS)-7AH-INDOL-3-YL]PROPAN-2-AMINE
Formula:	C23 H21 N5 O
SMILES:	N1=CC(=C2C=CC=CC12)CC(N)COc5cc(c3cc4c(cc3)nnc4)cnc5
InChi:	InChI=1S/C23H21N5O/c24-19(8-17-11-26-23-4-2-1-3-21(17)23)14-29-20-9-16(10-25-13-20)15-5-6-22-18(7-15)12-27-28-22/h1-7,9-13,19,23H,8,14,24H2,(H,27,28)/t19-,23?/m0/s1
Definition date:	2007-01-17
Last modified:	2011-06-04
Identifier:	(2S)-1-{[5-(1H-indazol-5-yl)pyridin-3-yl]oxy}-3-[(7aS)-7aH-indol-3-yl]propan-2-amine

ODP

ODP
Name:	4-OXO-NICOTINAMIDE-ADENINE DINUCLEOTIDE PHOSPHATE
Formula:	C21 H29 N7 O18 P3
SMILES:	NC(=O)[CH]1C=[N+](C=CC1=O)[CH]2O[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]3O[CH]([CH](O[P](O)(O)=O)[CH]3O)n4cnc5c(N)ncnc45)[CH](O)[CH]2O
InChi:	InChI=1S/C21H28N7O18P3/c22-17-12-19(25-6-24-17)28(7-26-12)21-16(45-47(34,35)36)14(31)11(44-21)5-42-49(39,40)46-48(37,38)41-4-10-13(30)15(32)20(43-10)27-2-1-9(29)8(3-27)18(23)33/h1-3,6-8,10-11,13-16,20-21,30-32H,4-5H2,(H7-,22,23,24,25,33,34,35,36,37,38,39,40)/p+1/t8-,10+,11+,13+,14+,15+,16+,20+,21+/m0/s1
Definition date:	2002-05-17
Last modified:	2011-06-04
Identifier:	[[(2R,3S,4R,5R)-5-(3-aminocarbonyl-4-oxo-3H-pyridin-1-ium-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-oxolan-2-yl]methyl hydrogen phosphate

ODS

ODS
Name:	4-methylpiperazine-1-carboxylic acid
Formula:	C6 H12 N2 O2
SMILES:	O=C(O)N1CCN(C)CC1
InChi:	InChI=1S/C6H12N2O2/c1-7-2-4-8(5-3-7)6(9)10/h2-5H2,1H3,(H,9,10)
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	4-methylpiperazine-1-carboxylic acid

OEF

OEF
Name:	3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACID
Formula:	C18 H18 Br2 O4
SMILES:	Brc2cc(cc(Br)c2Oc1cc(c(O)cc1)C(C)C)CCC(=O)O
InChi:	InChI=1S/C18H18Br2O4/c1-10(2)13-9-12(4-5-16(13)21)24-18-14(19)7-11(8-15(18)20)3-6-17(22)23/h4-5,7-10,21H,3,6H2,1-2H3,(H,22,23)
Definition date:	2006-08-28
Last modified:	2011-06-04
Identifier:	3-{3,5-dibromo-4-[4-hydroxy-3-(1-methylethyl)phenoxy]phenyl}propanoic acid

OEG

OEG
Name:	2,2'-oxydiacetic acid
Formula:	C4 H6 O5
SMILES:	O=C(O)COCC(=O)O
InChi:	InChI=1S/C4H6O5/c5-3(6)1-9-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
Definition date:	2008-03-28
Last modified:	2011-06-04
Identifier:	2,2'-oxydiacetic acid

2RB

2RB
Name:	N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-4-methoxybenzohydrazide
Formula:	C15 H12 Br2 N2 O4
SMILES:	Brc1cc(c(O)c(Br)c1O)C=NNC(=O)c2ccc(OC)cc2
InChi:	InChI=1S/C15H12Br2N2O4/c1-23-10-4-2-8(3-5-10)15(22)19-18-7-9-6-11(16)14(21)12(17)13(9)20/h2-7,20-21H,1H3,(H,19,22)/b18-7+
Definition date:	2008-07-16
Last modified:	2011-06-04
Identifier:	N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-4-methoxybenzohydrazide

OES

OES
Name:	N-OCTYL-2-HYDROXYETHYL SULFOXIDE
Formula:	C10 H22 O2 S
SMILES:	O=S(CCCCCCCC)CCO
InChi:	InChI=1S/C10H22O2S/c1-2-3-4-5-6-7-9-13(12)10-8-11/h11H,2-10H2,1H3/t13-/m1/s1
Definition date:	1999-08-12
Last modified:	2011-06-04
Identifier:	2-[(R)-octylsulfinyl]ethanol

OEV

OEV
Name:	(1S,2S,3R,6R)-4-(hydroxymethyl)-6-(octylamino)cyclohex-4-ene-1,2,3-triol
Formula:	C15 H29 N O4
SMILES:	OC1C(=CC(NCCCCCCCC)C(O)C1O)CO
InChi:	InChI=1S/C15H29NO4/c1-2-3-4-5-6-7-8-16-12-9-11(10-17)13(18)15(20)14(12)19/h9,12-20H,2-8,10H2,1H3/t12-,13-,14+,15+/m1/s1
Definition date:	2008-05-21
Last modified:	2011-06-04
Identifier:	(1S,2S,3R,6R)-4-(hydroxymethyl)-6-(octylamino)cyclohex-4-ene-1,2,3-triol

2RL

2RL
Name:	N-(4-CHLOROPHENYL)-7-[(6,7-DIMETHOXYQUINOLIN-4-YL)OXY]-2,3-DIHYDRO-1,4-BENZOXAZINE-4-CARBOXAMIDE
Formula:	C26 H22 Cl N3 O5
SMILES:	Clc1ccc(cc1)NC(=O)N2c5c(OCC2)cc(Oc3c4cc(OC)c(OC)cc4ncc3)cc5
InChi:	InChI=1S/C26H22ClN3O5/c1-32-24-14-19-20(15-25(24)33-2)28-10-9-22(19)35-18-7-8-21-23(13-18)34-12-11-30(21)26(31)29-17-5-3-16(27)4-6-17/h3-10,13-15H,11-12H2,1-2H3,(H,29,31)
Definition date:	2007-11-01
Last modified:	2011-06-04
Identifier:	N-(4-chlorophenyl)-7-[(6,7-dimethoxyquinolin-4-yl)oxy]-2,3-dihydro-4H-1,4-benzoxazine-4-carboxamide

OFI

OFI
Name:	N-[6-(4-hydroxyphenyl)-1H-indazol-3-yl]butanamide
Formula:	C17 H17 N3 O2
SMILES:	CCCC(=O)Nc1n[nH]c2cc(ccc12)c3ccc(O)cc3
InChi:	InChI=1S/C17H17N3O2/c1-2-3-16(22)18-17-14-9-6-12(10-15(14)19-20-17)11-4-7-13(21)8-5-11/h4-10,21H,2-3H2,1H3,(H2,18,19,20,22)
Definition date:	2010-01-20
Last modified:	2011-06-04
Identifier:	N-[6-(4-hydroxyphenyl)-1H-indazol-3-yl]butanamide

2S2

2S2
Name:	(2S)-2-(1H-indol-3-yl)hexanoic acid
Formula:	C14 H17 N O2
SMILES:	O=C(O)C(c2c1ccccc1nc2)CCCC
InChi:	InChI=1S/C14H17NO2/c1-2-3-6-11(14(16)17)12-9-15-13-8-5-4-7-10(12)13/h4-5,7-9,11,15H,2-3,6H2,1H3,(H,16,17)/t11-/m0/s1
Definition date:	2008-02-12
Last modified:	2011-06-04
Identifier:	(2S)-2-(1H-indol-3-yl)hexanoic acid

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