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DCI

DCI
Name:	2-METHYL-BUTYLAMINE
Formula:	C5 H13 N
SMILES:	NCC(C)CC
InChi:	InChI=1S/C5H13N/c1-3-5(2)4-6/h5H,3-4,6H2,1-2H3/t5-/m0/s1
Synonyms:	LEUCINOL
Definition date:	1999-07-08
Last modified:	2020-06-17
Identifier:	(2S)-2-methylbutan-1-amine

NU1

NU1
Name:	8-HYDROXY-2-METHYL-3-HYDRO-QUINAZOLIN-4-ONE
Formula:	C9 H8 N2 O2
SMILES:	O=C1c2c(N=C(N1)C)c(O)ccc2
InChi:	InChI=1S/C9H8N2O2/c1-5-10-8-6(9(13)11-5)3-2-4-7(8)12/h2-4,12H,1H3,(H,10,11,13)
Synonyms:	NU1025
Definition date:	1999-07-08
Last modified:	2020-06-17
Identifier:	8-hydroxy-2-methylquinazolin-4(3H)-one

DCK

DCK
Name:	(2S)-3-carboxy-2-hydroxy-N,N,N-trimethylpropan-1-aminium
Formula:	C7 H16 N O3
SMILES:	O=C(O)CC(O)C[N+](C)(C)C
InChi:	InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/p+1/t6-/m0/s1
Synonyms:	D-carnitine
Definition date:	2010-12-09
Last modified:	2020-06-17
Identifier:	(2S)-3-carboxy-2-hydroxy-N,N,N-trimethylpropan-1-aminium

DCQ

DCQ
Name:	2-decyl-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
Formula:	C19 H30 O4
SMILES:	O=C1C(=C(C(=O)C(OC)=C1OC)C)CCCCCCCCCC
InChi:	InChI=1S/C19H30O4/c1-5-6-7-8-9-10-11-12-13-15-14(2)16(20)18(22-3)19(23-4)17(15)21/h5-13H2,1-4H3
Synonyms:	decylubiquinone
Definition date:	2009-04-17
Last modified:	2020-06-17
Identifier:	2-decyl-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione

DCS

DCS
Name:	D-[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YLMETHYL]-N,O-CYCLOSERYLAMIDE
Formula:	C11 H16 N3 O7 P
SMILES:	O=C2NOCC2NCc1c(cnc(c1O)C)COP(=O)(O)O
InChi:	InChI=1S/C11H16N3O7P/c1-6-10(15)8(3-13-9-5-20-14-11(9)16)7(2-12-6)4-21-22(17,18)19/h2,9,13,15H,3-5H2,1H3,(H,14,16)(H2,17,18,19)/t9-/m1/s1
Synonyms:	D-PYRIDOXYL-N,O-CYCLOSERYLAMIDE-5-MONOPHOSPHATE
Definition date:	1999-10-28
Last modified:	2020-06-17
Identifier:	[5-hydroxy-6-methyl-4-({[(4R)-3-oxoisoxazolidin-4-yl]amino}methyl)pyridin-3-yl]methyl dihydrogen phosphate

DCU

DCU
Name:	3,8-DIAMINO-5,10'-(TRIMETHYLAMMONIUM)DECYL-6-PHENYL PHENANTHRIDINIUM
Formula:	C32 H44 N4
SMILES:	c4c3c1ccc(cc1c(c2ccccc2)[n+](c3cc(N)c4)CCCCCCCCCC[N+](C)(C)C)N
InChi:	InChI=1S/C32H43N4/c1-36(2,3)22-14-9-7-5-4-6-8-13-21-35-31-24-27(34)18-20-29(31)28-19-17-26(33)23-30(28)32(35)25-15-11-10-12-16-25/h10-12,15-20,23-24,34H,4-9,13-14,21-22,33H2,1-3H3/q+1/p+1
Synonyms:	DECIDIUM
Definition date:	2002-12-11
Last modified:	2020-06-17
Identifier:	3,8-diamino-6-phenyl-5-[10-(trimethylammonio)decyl]phenanthridinium

NUF

NUF
Name:	[2,2'-{(4,5-difluorobenzene-1,2-diyl)bis[(nitrilo-kappaN)methylylidene]}bis{5-[2-(piperidin-1-yl)ethoxy]phenolato-kappa O}(2-)]nickel (II)
Formula:	C34 H38 F2 N4 Ni O4
SMILES:	Fc8cc3c(N5=Cc7c(O[Ni]54Oc2cc(OCCN1CCCCC1)ccc2C=N34)cc(OCCN6CCCCC6)cc7)cc8F
InChi:	InChI=1S/C34H40F2N4O4.Ni/c35-29-21-31(37-23-25-7-9-27(19-33(25)41)43-17-15-39-11-3-1-4-12-39)32(22-30(29)36)38-24-26-8-10-28(20-34(26)42)44-18-16-40-13-5-2-6-14-40
Synonyms:	N,N-Bis[4-[[1-(2-ethyl)piperidine]oxy]salicylidene]-4,5-difluoro-1,2-phenylenediamine-Nickel (II)
Definition date:	2011-03-03
Last modified:	2020-06-17
Identifier:	[2,2'-{(4,5-difluorobenzene-1,2-diyl)bis[(nitrilo-kappaN)methylylidene]}bis{5-[2-(piperidin-1-yl)ethoxy]phenolato-kappaO}(2-)]nickel

DDC

DDC
Name:	7-HYDROXY-2-PHENYL-CHROMAN-4-ONE
Formula:	C15 H12 O3
SMILES:	O=C2c3c(OC(c1ccccc1)C2)cc(O)cc3
InChi:	InChI=1S/C15H12O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-8,14,16H,9H2/t14-/m0/s1
Synonyms:	5,4'-DIDEOXYFLAVANONE
Definition date:	2000-08-30
Last modified:	2020-06-17
Identifier:	(2S)-7-hydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one

NV2

NV2
Name:	5-[1-(1,3-dimethoxypropan-2-yl)-5-morpholin-4-yl-benzimidazol-2-yl]-1,3-dimethyl-pyridin-2-one
Formula:	C23 H30 N4 O4
SMILES:	COCC(COC)n1c2ccc(cc2nc1C3=CN(C)C(=O)C(=C3)C)N4CCOCC4
InChi:	InChI=1S/C23H30N4O4/c1-16-11-17(13-25(2)23(16)28)22-24-20-12-18(26-7-9-31-10-8-26)5-6-21(20)27(22)19(14-29-3)15-30-4/h5-6,11-13,19H,7-10,14-15H2,1-4H3
Synonyms:	5-(1-(1,3-dimethoxypropan-2-yl)-5-morpholino-1H-benzo[d]imidazol-2-yl)-1,3-dimethylpyridin-2(1H)-one
Definition date:	2019-12-16
Last modified:	2020-06-17
Release date:	2020-01-15
Identifier:	5-[1-(1,3-dimethoxypropan-2-yl)-5-morpholin-4-yl-benzimidazol-2-yl]-1,3-dimethyl-pyridin-2-one

DDJ

DDJ
Name:	3,3'-dimethoxybiphenyl-4,4'-diamine
Formula:	C14 H16 N2 O2
SMILES:	O(c1cc(ccc1N)c2ccc(N)c(OC)c2)C
InChi:	InChI=1S/C14H16N2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,15-16H2,1-2H3
Synonyms:	o-Dianisidine
Definition date:	2011-12-12
Last modified:	2020-06-17
Release date:	2012-11-30
Identifier:	3,3'-dimethoxybiphenyl-4,4'-diamine

1L2

1L2
Name:	(2S)-3-(alpha-D-galactopyranosyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl (9Z,12Z)-octadeca-9,12-dienoate
Formula:	C45 H80 O10
SMILES:	O=C(OCC(OC(=O)CCCCCCCC=C/CCCCCCCC)COC1OC(C(O)C(O)C1O)CO)CCCCCCCC=C/CC=C/CCCCC
InChi:	InChI=1S/C45H80O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17-20,38-39,42-46,49-51H,3-10,12,14-16,21-37H2,1-2H3/b13-11-,19-17-,20-18-/t38-,39-,42+,43+,44-,45+/m1/s1
Synonyms:	1-linoleoyl,2-oleoyl-3-O-(alpha-D-galactopyranosyl)-sn-glycerol
Definition date:	2009-08-10
Last modified:	2020-06-17
Identifier:	(2S)-3-(alpha-D-galactopyranosyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl (9Z,12Z)-octadeca-9,12-dienoate

DDR

DDR
Name:	(2S)-3-hydroxypropane-1,2-diyl didecanoate
Formula:	C23 H44 O5
SMILES:	O=C(OC(COC(=O)CCCCCCCCC)CO)CCCCCCCCC
InChi:	InChI=1S/C23H44O5/c1-3-5-7-9-11-13-15-17-22(25)27-20-21(19-24)28-23(26)18-16-14-12-10-8-6-4-2/h21,24H,3-20H2,1-2H3/t21-/m0/s1
Synonyms:	1,2-DIDECANOYL-SN-GLYCEROL
Definition date:	2007-10-04
Last modified:	2020-06-17
Identifier:	(2S)-3-hydroxypropane-1,2-diyl didecanoate

DDY

DDY
Name:	2',3'-DIDEOXYCYTOSINE-5'-DIPHOSPHATE
Formula:	C9 H15 N3 O9 P2
SMILES:	O=P(O)(O)OP(=O)(O)OCC2OC(N1C(=O)N=C(N)C=C1)CC2
InChi:	InChI=1S/C9H15N3O9P2/c10-7-3-4-12(9(13)11-7)8-2-1-6(20-8)5-19-23(17,18)21-22(14,15)16/h3-4,6,8H,1-2,5H2,(H,17,18)(H2,10,11,13)(H2,14,15,16)/t6-,8+/m0/s1
Synonyms:	DDCDP
Definition date:	2004-04-19
Last modified:	2020-06-17
Identifier:	[(2S,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl trihydrogen diphosphate

NVP

NVP
Name:	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL-6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN-6-ONE
Formula:	C15 H14 N4 O
SMILES:	O=C2Nc1c(ccnc1N(c3ncccc23)C4CC4)C
InChi:	InChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)
Synonyms:	NON-NUCLEOSIDE RT INHIBITOR NEVIRAPINE
Definition date:	2000-08-15
Last modified:	2020-06-17
Identifier:	11-cyclopropyl-4-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one

DE9

DE9
Name:	3,3'-(3,7,12,17-tetramethylporphyrin-2,18-diyl)dipropanoic acid
Formula:	C30 H30 N4 O4
SMILES:	O=C(O)CCC5=C(c2nc5cc1c(c(c(n1)cc4nc(cc3cc(c(c2)n3)C)C(=C4)C)C)CCC(=O)O)C
InChi:	InChI=1S/C30H30N4O4/c1-15-9-20-12-25-17(3)21(5-7-29(35)36)27(33-25)14-28-22(6-8-30(37)38)18(4)26(34-28)13-24-16(2)10-19(32-24)11-23(15)31-20/h9-14,32-33H,5-8H2,1-4H3,(H,35,36)(H,37,38)/b19-11-,20-12-,23-11-,24-13-,25-12-,26-13-,27-14-,28-14-
Synonyms:	deuteroporphyrin IX
Definition date:	2015-01-21
Last modified:	2020-06-17
Release date:	2015-05-20
Identifier:	3,3'-(3,7,12,17-tetramethylporphyrin-2,18-diyl)dipropanoic acid

DEQ

DEQ
Name:	DEQUALINIUM
Formula:	C30 H40 N4
SMILES:	c12ccccc1c(cc([n+]2CCCCCCCCCC[n+]4c3ccccc3c(N)cc4C)C)N
InChi:	InChI=1S/C30H38N4/c1-23-21-27(31)25-15-9-11-17-29(25)33(23)19-13-7-5-3-4-6-8-14-20-34-24(2)22-28(32)26-16-10-12-18-30(26)34/h9-12,15-18,21-22,31-32H,3-8,13-14,19-20H2,1-2H3/p+2
Synonyms:	DEQUADIN
Definition date:	2001-08-30
Last modified:	2020-06-17
Identifier:	1,1'-decane-1,10-diylbis(4-amino-2-methylquinolinium)

NWD

NWD
Name:	3-(5-nitro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine
Formula:	C7 H8 N4 O6
SMILES:	O=C(O)C(N)CN1C=C(C(=O)NC1=O)[N+]([O-])=O
InChi:	InChI=1S/C7H8N4O6/c8-3(6(13)14)1-10-2-4(11(16)17)5(12)9-7(10)15/h2-3H,1,8H2,(H,13,14)(H,9,12,15)/t3-/m0/s1
Synonyms:	nitrowillardiine
Definition date:	2011-05-05
Last modified:	2020-06-17
Identifier:	3-(5-nitro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine

NWH

NWH
Name:	N-[(2S)-heptan-2-yl]formamide
Formula:	C8 H17 N O
SMILES:	CCCCCC(C)NC=O
InChi:	InChI=1S/C8H17NO/c1-3-4-5-6-8(2)9-7-10/h7-8H,3-6H2,1-2H3,(H,9,10)/t8-/m0/s1
Synonyms:	(S)-N-1-methylhexylformamide
Definition date:	2017-05-02
Last modified:	2020-06-17
Release date:	2017-05-10
Identifier:	N-[(2S)-heptan-2-yl]formamide

DEX

DEX
Name:	DEXAMETHASONE
Formula:	C22 H29 F O5
SMILES:	O=C(CO)C3(O)C2(CC(O)C4(F)C1(C(=CC(=O)C=C1)CCC4C2CC3C)C)C
InChi:	InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
Synonyms:	9A-FLUORO-16BETA-METHYLPREDNISOLONE
Definition date:	2002-07-19
Last modified:	2020-06-17
Identifier:	(11alpha,14beta,16alpha,17alpha)-9-fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione

DEY

DEY
Name:	(2R)-2-({3-[5-hydroxy-2-(3-methylbutyl)-3-oxo-6-thiophen-2-yl-2,3-dihydropyridazin-4-yl]-1,1-dioxido-2H-1,2,4-benzothia diazin-7-yl}oxy)propanamide
Formula:	C23 H25 N5 O6 S2
SMILES:	O=C(N)C(Oc1ccc2N=C(NS(=O)(=O)c2c1)C3=C(O)C(=NN(C3=O)CCC(C)C)c4sccc4)C
InChi:	InChI=1S/C23H25N5O6S2/c1-12(2)8-9-28-23(31)18(20(29)19(26-28)16-5-4-10-35-16)22-25-15-7-6-14(34-13(3)21(24)30)11-17(15)36(32,33)27-22/h4-7,10-13,29H,8-9H2,1-3H3,(H2,24,30)(H,25,27)/t13-/m1/s1
Synonyms:	(2R)-2-({3-[5-HYDROXY-2-(3-METHYLBUTYL)-3-OXO-6-THIOPHEN-2-YL-2,3-DIHYDROPYRIDAZIN-4-YL]-1,1-DIOXO-2H-1,2,4-BENZOTHIADI AZIN-7-YL}OXY)PROPANAMIDE
Definition date:	2008-01-02
Last modified:	2020-06-17
Identifier:	(2R)-2-({3-[5-hydroxy-2-(3-methylbutyl)-3-oxo-6-thiophen-2-yl-2,3-dihydropyridazin-4-yl]-1,1-dioxido-2H-1,2,4-benzothiadiazin-7-yl}oxy)propanamide

DFL

DFL
Name:	2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE
Formula:	C15 H12 O3
SMILES:	O=C2c3c(OC(c1ccc(O)cc1)C2)cccc3
InChi:	InChI=1S/C15H12O3/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,15-16H,9H2/t15-/m0/s1
Synonyms:	4'-HYDROXYFLAVANONE
Definition date:	2001-06-28
Last modified:	2020-06-17
Identifier:	(2S)-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one

DFM

DFM
Name:	N-ACETYL-L-PHENYLALANYL-4-[DIFLUORO(PHOSPHONO)METHYL]-L-PHENYLALANINAMIDE
Formula:	C21 H24 F2 N3 O6 P
SMILES:	FC(F)(c1ccc(cc1)CC(C(=O)N)NC(=O)C(NC(=O)C)Cc2ccccc2)P(=O)(O)O
InChi:	InChI=1S/C21H24F2N3O6P/c1-13(27)25-18(12-14-5-3-2-4-6-14)20(29)26-17(19(24)28)11-15-7-9-16(10-8-15)21(22,23)33(30,31)32/h2-10,17-18H,11-12H2,1H3,(H2,24,28)(H,25,27)(H,26,29)(H2,30,31,32)/t17-,18-/m0/s1
Synonyms:	DIFLUOROMETHYLPHOSPHONIC ACID ANALOG
Definition date:	2006-05-04
Last modified:	2020-06-17
Identifier:	N-acetyl-L-phenylalanyl-4-[difluoro(phosphono)methyl]-L-phenylalaninamide

DFQ

DFQ
Name:	(2E)-3-{6-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]quinolin-3-yl}-N-methylprop-2-enamide
Formula:	C21 H17 Cl2 F N2 O2
SMILES:	Clc1ccc(F)c(Cl)c1C(Oc2ccc3ncc(cc3c2)C=CC(=O)NC)C
InChi:	InChI=1S/C21H17Cl2FN2O2/c1-12(20-16(22)5-6-17(24)21(20)23)28-15-4-7-18-14(10-15)9-13(11-26-18)3-8-19(27)25-2/h3-12H,1-2H3,(H,25,27)/b8-3+/t12-/m1/s1
Synonyms:	(E)-3-{6-[(1R)-1-(2,6-dichloro-3-fluoro-phenyl)-ethoxy]-quinolin-3-yl}-n-methyl-acrylamide
Definition date:	2009-07-14
Last modified:	2020-06-17
Identifier:	(2E)-3-{6-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]quinolin-3-yl}-N-methylprop-2-enamide

DFU

DFU
Name:	(2S,3R,4S,5R)-2-METHYLPIPERIDINE-3,4,5-TRIOL
Formula:	C6 H13 N O3
SMILES:	OC1C(NCC(O)C1O)C
InChi:	InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
Synonyms:	DEOXYFUCONOJIRIMYCIN
Definition date:	2007-02-06
Last modified:	2020-06-17
Identifier:	(2S,3R,4S,5R)-2-methylpiperidine-3,4,5-triol

DG1

DG1
Name:	(4S)-ISONICOTINIC-ACETYL-NICOTINAMIDE-ADENINE DINUCLEOTIDE
Formula:	C27 H33 N8 O18 P3
SMILES:	NC(=O)C1=CN(C=C[CH]1C(=O)c2ccncc2)[CH]3O[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]4O[CH]([CH](O[P](O)(O)=O)[CH]4O)n5cnc6c(N)ncnc56)[CH](O)[CH]3O
InChi:	InChI=1S/C27H33N8O18P3/c28-23-17-25(32-10-31-23)35(11-33-17)27-22(52-54(41,42)43)20(38)16(51-27)9-49-56(46,47)53-55(44,45)48-8-15-19(37)21(39)26(50-15)34-6-3-13(14(7-34)24(29)40)18(36)12-1-4-30-5-2-12/h1-7,10-11,13,15-16,19-22,26-27,37-39H,8-9H2,(H2,29,40)(H,44,45)(H,46,47)(H2,28,31,32)(H2,41,42,43)/t13-,15+,16+,19+,20+,21+,22+,26+,27+/m0/s1
Synonyms:	{(2R,3S,4R,5R)-5-[(4S)-3-(AMINOCARBONYL)-4-ISONICOTINOYLPYRIDIN-1(4H)-YL]-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL}METHYL [(2R,3R,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3-HYDROXY-4-(PHOSPHONOOXY)TETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN DIPHOSPHATE
Definition date:	2007-06-22
Last modified:	2020-06-17
Identifier:	[(2R,3S,4R,5R)-5-[(4S)-3-aminocarbonyl-4-pyridin-4-ylcarbonyl-4H-pyridin-1-yl]-3,4-dihydroxy-oxolan-2-yl]methyl [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate

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