Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help
NJP
NJP
Name:5-hydroxy-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Formula:C21 H29 N7 O18 P3
SMILES:NC(=O)c1cc(O)c[n+](c1)[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)27-2-8(18(23)33)1-9(29)3-27/h1-3,6-7,10-11,13-16,20-21,30-32H,4-5H2,(H8-,22,23,24,25,29,33,34,35,36,37,38,39,40)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
Synonyms:5-hydroxy-NADP
Definition date:2010-02-12
Last modified:2020-06-17
Identifier:[[(2R,3S,4R,5R)-5-(3-aminocarbonyl-5-hydroxy-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
ZIL
ZIL
Name:N-[(benzyloxy)carbonyl]-L-isoleucyl-L-leucine
Formula:C20 H30 N2 O5
SMILES:O=C(O)C(NC(=O)C(NC(=O)OCc1ccccc1)C(C)CC)CC(C)C
InChi:InChI=1S/C20H30N2O5/c1-5-14(4)17(18(23)21-16(19(24)25)11-13(2)3)22-20(26)27-12-15-9-7-6-8-10-15/h6-10,13-14,16-17H,5,11-12H2,1-4H3,(H,21,23)(H,22,26)(H,24,25)/t14-,16-,17-/m0/s1
Synonyms:Z-Ile-Leu
Definition date:2014-07-23
Last modified:2020-06-17
Release date:2014-10-08
Identifier:N-[(benzyloxy)carbonyl]-L-isoleucyl-L-leucine
ZYU
ZYU
Name:6-MORPHOLIN-4-YL-9H-PURINE
Formula:C9 H11 N5 O
SMILES:n2cnc1c(ncn1)c2N3CCOCC3
InChi:InChI=1S/C9H11N5O/c1-3-15-4-2-14(1)9-7-8(11-5-10-7)12-6-13-9/h5-6H,1-4H2,(H,10,11,12,13)
Synonyms:4-(9H-PURIN-6-YL)MORPHOLINE
Definition date:2009-07-03
Last modified:2020-06-17
Identifier:6-morpholin-4-yl-9H-purine
ZYV
ZYV
Name:1-[(2S)-4-(7H-PURIN-6-YL)MORPHOLIN-2-YL]METHANAMINE
Formula:C10 H14 N6 O
SMILES:n1cnc3ncnc3c1N2CC(OCC2)CN
InChi:InChI=1S/C10H14N6O/c11-3-7-4-16(1-2-17-7)10-8-9(13-5-12-8)14-6-15-10/h5-7H,1-4,11H2,(H,12,13,14,15)/t7-/m0/s1
Synonyms:(4-(9H-PURIN-6-YL)MORPHOLIN-2-YL)METHANAMINE
Definition date:2009-07-03
Last modified:2020-06-17
Identifier:1-[(2S)-4-(7H-purin-6-yl)morpholin-2-yl]methanamine
ZZ1
ZZ1
Name:4-METHYL-2H-CHROMEN-2-ONE
Formula:C10 H8 O2
SMILES:O=C2Oc1ccccc1C(=C2)C
InChi:InChI=1S/C10H8O2/c1-7-6-10(11)12-9-5-3-2-4-8(7)9/h2-6H,1H3
Synonyms:4-METHYLUMBELLIFERYL
Definition date:2006-03-24
Last modified:2020-06-17
Identifier:4-methyl-2H-chromen-2-one
ZZ2
ZZ2
Name:4-(2-methoxyethoxy)-6-methylpyrimidin-2-amine
Formula:C8 H13 N3 O2
SMILES:O(c1nc(nc(c1)C)N)CCOC
InChi:InChI=1S/C8H13N3O2/c1-6-5-7(11-8(9)10-6)13-4-3-12-2/h5H,3-4H2,1-2H3,(H2,9,10,11)
Synonyms:4-(2-methoxy-ethoxy)-6-methyl-pyrimidine-2-ylamine
Definition date:2009-05-08
Last modified:2020-06-17
Identifier:4-(2-methoxyethoxy)-6-methylpyrimidin-2-amine
FGG
FGG
Name:(2Z,6E,10E)-2-fluoro-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate
Formula:C20 H35 F O7 P2
SMILES:O=P(O)(O)OP(=O)(OCC(F)=C(/C)CCC=C(/C)CCC=C(/C)CCC=C(/C)C)O
InChi:InChI=1S/C20H35FO7P2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)20(21)15-27-30(25,26)28-29(22,23)24/h9,11,13H,6-8,10,12,14-15H2,1-5H3,(H,25,26)(H2,22,23,24)/b17-11+,18-13+,20-19-
Synonyms:2-fluoro-geranylgeranyl diphosphate
Definition date:2010-10-22
Last modified:2020-06-17
Identifier:(2Z,6E,10E)-2-fluoro-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate
NKQ
NKQ
Name:(2R)-2-hydroxy-3-(phosphonooxy)propyl (9E,12Z,15Z)-octadeca-9,12,15-trienoate
Formula:C21 H37 O7 P
SMILES:O=P(OCC(O)COC(=O)CCCCCCC/C=C/CC=C/CC=C/CC)(O)O
InChi:InChI=1S/C21H37O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h3-4,6-7,9-10,20,22H,2,5,8,11-19H2,1H3,(H2,24,25,26)/b4-3-,7-6-,10-9+/t20-/m1/s1
Synonyms:18:3 LPA, 1-linolenoyl-lysophosphatidic acid
Definition date:2010-11-05
Last modified:2020-06-17
Identifier:(2R)-2-hydroxy-3-(phosphonooxy)propyl (9E,12Z,15Z)-octadeca-9,12,15-trienoate
ZZZ
ZZZ
Name:6-FORMYLTETRAHYDROPTERIN
Formula:C7 H9 N5 O2
SMILES:O=CC1NC=2C(=O)NC(=NC=2NC1)N
InChi:InChI=1S/C7H9N5O2/c8-7-11-5-4(6(14)12-7)10-3(2-13)1-9-5/h2-3,10H,1H2,(H4,8,9,11,12,14)/t3-/m1/s1
Synonyms:(6S)-2-AMINO-4-OXO-3,4,5,6,7,8-HEXAHYDROPTERIDINE-6-CARBALDEHYDE
Definition date:2006-02-21
Last modified:2020-06-17
Identifier:(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridine-6-carbaldehyde
ZK1
ZK1
Name:{[7-morpholin-4-yl-2,3-dioxo-6-(trifluoromethyl)-3,4-dihydroquinoxalin-1(2H)-yl]methyl}phosphonic acid
Formula:C14 H15 F3 N3 O6 P
SMILES:O[P](O)(=O)CN1C(=O)C(=O)Nc2cc(c(cc12)N3CCOCC3)C(F)(F)F
InChi:InChI=1S/C14H15F3N3O6P/c15-14(16,17)8-5-9-11(6-10(8)19-1-3-26-4-2-19)20(7-27(23,24)25)13(22)12(21)18-9/h5-6H,1-4,7H2,(H,18,21)(H2,23,24,25)
Synonyms:[[3,4-Dihydro-7-(4-morpholinyl)-2,3-dioxo-6-(trifluorom ethyl)-1(2H)-quinoxalinyl]methyl]phosphonic acid
Definition date:2009-11-13
Last modified:2020-06-17
Identifier:[7-morpholin-4-yl-2,3-dioxo-6-(trifluoromethyl)-4H-quinoxalin-1-yl]methylphosphonic acid
FHI
FHI
Name:2',4'-DIFLUORO-4-HYDROXY-5-IODO-1,1'-BIPHENYL-3-CARBOXYLIC ACID
Formula:C13 H7 F2 I O3
SMILES:Ic2cc(c1ccc(F)cc1F)cc(C(=O)O)c2O
InChi:InChI=1S/C13H7F2IO3/c14-7-1-2-8(10(15)5-7)6-3-9(13(18)19)12(17)11(16)4-6/h1-5,17H,(H,18,19)
Synonyms:IODODIFLUNISAL
Definition date:2004-12-09
Last modified:2020-06-17
Identifier:2',4'-difluoro-4-hydroxy-5-iodobiphenyl-3-carboxylic acid
FHP
FHP
Name:1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID
Formula:C15 H27 O4 P
SMILES:O=P(O)(O)C(O)/C=C(/CCC=C(/C)CCC=C(/C)C)C
InChi:InChI=1S/C15H27O4P/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15(16)20(17,18)19/h7,9,11,15-16H,5-6,8,10H2,1-4H3,(H2,17,18,19)/b13-9+,14-11+/t15-/m1/s1
Synonyms:FARNESYL HYDROXYPHOSPHONATE
Definition date:1999-07-08
Last modified:2020-06-17
Identifier:[(1R,2E,6E)-1-hydroxy-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]phosphonic acid
Y5P
Y5P
Name:1-(5-O-phosphono-beta-D-ribofuranosyl)-1,4-dihydropyrimidine
Formula:C9 H15 N2 O7 P
SMILES:O=P(O)(O)OCC2OC(N1C=NCC=C1)C(O)C2O
InChi:InChI=1S/C9H15N2O7P/c12-7-6(4-17-19(14,15)16)18-9(8(7)13)11-3-1-2-10-5-11/h1,3,5-9,12-13H,2,4H2,(H2,14,15,16)/t6-,7-,8-,9-/m1/s1
Synonyms:PYRIMIDINE RIBOSIDE-5'-MONOPHOSPHATE
Definition date:2014-09-25
Last modified:2020-06-17
Release date:2014-10-08
Identifier:1-(5-O-phosphono-beta-D-ribofuranosyl)-1,4-dihydropyrimidine
NLQ
NLQ
Name:N~2~-ACETYL-L-GLUTAMINE
Formula:C7 H12 N2 O4
SMILES:O=C(NC(C(=O)O)CCC(=O)N)C
InChi:InChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)/t5-/m0/s1
Synonyms:N-ACETYL-L-GLUTAMINE
Definition date:2004-10-12
Last modified:2020-06-17
Identifier:N~2~-acetyl-L-glutamine
ZLD
ZLD
Name:N-{[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide
Formula:C16 H20 F N3 O4
SMILES:O=C1OC(CNC(=O)C)CN1c3cc(F)c(N2CCOCC2)cc3
InChi:InChI=1S/C16H20FN3O4/c1-11(21)18-9-13-10-20(16(22)24-13)12-2-3-15(14(17)8-12)19-4-6-23-7-5-19/h2-3,8,13H,4-7,9-10H2,1H3,(H,18,21)/t13-/m0/s1
Synonyms:Linezolid
Definition date:2008-06-03
Last modified:2020-06-17
Identifier:N-{[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide
FID
FID
Name:(2S,4S)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE
Formula:C12 H10 F N3 O4
SMILES:Fc3ccc2OC(C(=O)N)CC1(C(=O)NC(=O)N1)c2c3
InChi:InChI=1S/C12H10FN3O4/c13-5-1-2-7-6(3-5)12(4-8(20-7)9(14)17)10(18)15-11(19)16-12/h1-3,8H,4H2,(H2,14,17)(H2,15,16,18,19)/t8-,12-/m0/s1
Synonyms:FIDARESTAT
Definition date:2000-02-14
Last modified:2020-06-17
Identifier:(2S,4S)-6-fluoro-2',5'-dioxo-2,3-dihydrospiro[chromene-4,4'-imidazolidine]-2-carboxamide
NMA
NMA
Name:N-[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YLMETHYL]-2-METHYLALANINE
Formula:C12 H19 N2 O7 P
SMILES:O=C(O)C(NCc1c(cnc(c1O)C)COP(=O)(O)O)(C)C
InChi:InChI=1S/C12H19N2O7P/c1-7-10(15)9(5-14-12(2,3)11(16)17)8(4-13-7)6-21-22(18,19)20/h4,14-15H,5-6H2,1-3H3,(H,16,17)(H2,18,19,20)
Synonyms:N-PYRIDOXYL-2-METHYLALANINE-5-PHOSPHATE
Definition date:1999-11-17
Last modified:2020-06-17
Identifier:N-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)-2-methyl-D-alanine
YXR
YXR
Name:(2R)-sulfonatepropionyl-CoA
Formula:C24 H40 N7 O20 P3 S2
SMILES:OP(OC1C(OC(C1O)n2cnc3c2ncnc3N)COP(OP(OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)C(C)S(O)(=O)=O)(O)=O)(O)=O)(O)=O
InChi:InChI=1S/C24H40N7O20P3S2/c1-12(56(44,45)46)23(36)55-7-6-26-14(32)4-5-27-21(35)18(34)24(2,3)9-48-54(42,43)51-53(40,41)47-8-13-17(50-52(37,38)39)16(33)22(49-13)31-11-30-15-19(25)28-10-29-20(15)31/h10-13,16-18,22,33-34H,4-9H2,1-3H3,(H,26,32)(H,27,35)(H,40,41)(H,42,43)(H2,25,28,29)(H2,37,38,39)(H,44,45,46)/t12-,13-,16-,17-,18+,22-/m1/s1
Synonyms:(2~{R})-1-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]me thoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethylsulfany l]-1-oxidanylidene-propane-2-sulfonic acid
Definition date:2018-12-03
Last modified:2020-06-17
Release date:2019-04-10
Identifier:(3S,5R,9R,20R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphahenicosane-20-sulfonic acid 3,5-dioxide (non-preferred name)
FIL
FIL
Name:(1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O-(AMINOCARBONYL)OXIME
Formula:C15 H20 N2 O4
SMILES:COc1ccc(cc1OC2CCCC2)C(C)=NOC(N)=O
InChi:InChI=1S/C15H20N2O4/c1-10(17-21-15(16)18)11-7-8-13(19-2)14(9-11)20-12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3,(H2,16,18)/b17-10+
Synonyms:FILAMINAST
Definition date:2004-11-17
Last modified:2020-06-17
Identifier:[1-(3-cyclopentyloxy-4-methoxy-phenyl)ethylideneamino] carbamate
FIV
FIV
Name:naphthalene-2-carboxylic acid
Formula:C11 H8 O2
SMILES:O=C(O)c2ccc1c(cccc1)c2
InChi:InChI=1S/C11H8O2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,12,13)
Synonyms:2-naphthoic acid
Definition date:2012-04-10
Last modified:2020-06-17
Release date:2013-02-15
Identifier:naphthalene-2-carboxylic acid
NMN
NMN
Name:BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE
Formula:C11 H16 N2 O8 P
SMILES:O=C(c1ccc[n+](c1)C2OC(C(O)C2O)COP(=O)(O)O)N
InChi:InChI=1S/C11H15N2O8P/c12-10(16)6-2-1-3-13(4-6)11-9(15)8(14)7(21-11)5-20-22(17,18)19/h1-4,7-9,11,14-15H,5H2,(H3-,12,16,17,18,19)/p+1/t7-,8-,9-,11-/m1/s1
Synonyms:NICOTINAMIDE MONONUCLEOTIDE
Definition date:2001-01-24
Last modified:2020-06-17
Identifier:3-carbamoyl-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium
YYG
YYG
Name:4-(3-[5-O-PHOSPHONORIBOFURANOSYL]-4,6-DIMETHYL-8-OXO-4,8-DIHYDRO-3H-1,3,4,5,7A-PENTAAZA-S-INDACEN-YLAMINO-BUTYRIC ACID METHYL ESTER
Formula:C21 H29 N6 O12 P
SMILES:O=C(OC)C(NC(=O)OC)CCc3c(nc4N(c1c(ncn1C2OC(C(O)C2O)COP(=O)(O)O)C(=O)n34)C)C
InChi:InChI=1S/C21H29N6O12P/c1-9-11(6-5-10(19(31)36-3)24-21(32)37-4)27-17(30)13-16(25(2)20(27)23-9)26(8-22-13)18-15(29)14(28)12(39-18)7-38-40(33,34)35/h8,10,12,14-15,18,28-29H,5-7H2,1-4H3,(H,24,32)(H2,33,34,35)/t10-,12+,14+,15+,18+/m0/s1
Synonyms:MODIFIED GUANOSINE-5'-PHOSPHATE
Definition date:1999-10-04
Last modified:2020-06-17
Identifier:7-{(3S)-4-methoxy-3-[(methoxycarbonyl)amino]-4-oxobutyl}-4,6-dimethyl-3-(5-O-phosphono-beta-D-ribofuranosyl)-3,4-dihydro-9H-imidazo[1,2-a]purin-9-one
NMY
NMY
Name:NEOMYCIN
Formula:C23 H46 N6 O13
SMILES:O(C2C(OC1OC(CN)C(O)C(O)C1N)C(N)CC(N)C2O)C4OC(C(OC3OC(CN)C(O)C(O)C3N)C4O)CO
InChi:InChI=1S/C23H46N6O13/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22/h5-23,30-36H,1-4,24-29H2/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1
Synonyms:MYCIFRADIN
Definition date:2007-07-25
Last modified:2020-06-17
Identifier:(1R,2R,3S,4R,6S)-4,6-diamino-2-{[3-O-(2,6-diamino-2,6-dideoxy-beta-L-idopyranosyl)-beta-D-ribofuranosyl]oxy}-3-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside
NMZ
NMZ
Name:(2S)-4-amino-N-{(1R,2S,3R,4R,5S)-5-amino-3-{[3-O-(2,6-diamino-2,6-dideoxy-beta-L-idopyranosyl)-beta-D-ribofuranosyl]oxy }-4-[(2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-galactopyranosyl)oxy]-2-hydroxycyclohexyl}-2-hydroxybutanamide
Formula:C27 H52 F N7 O14
SMILES:FC1C(O)C(N)C(OC1CN)OC4C(N)CC(NC(=O)C(O)CCN)C(O)C4OC3OC(C(OC2OC(CN)C(O)C(O)C2N)C3O)CO
InChi:InChI=1S/C27H52FN7O14/c28-13-10(4-30)44-25(14(33)18(13)40)47-21-7(32)3-8(35-24(43)9(37)1-2-29)16(38)23(21)49-27-20(42)22(12(6-36)46-27)48-26-15(34)19(41)17(39)11(5-31)45-26/h7-23,25-27,36-42H,1-6,29-34H2,(H,35,43)/t7-,8+,9-,10+,11-,12+,13-,14+,15+,16-,17+,18-,19+,20+,21+,22+,23+,25+,26+,27-/m0/s1
Synonyms:1-N-[(S)-4-Amino-2-hydroxybutanoyl]-4'-deoxy-4'-fluoro-4'-epineomycin
Definition date:2014-05-16
Last modified:2020-06-17
Release date:2015-01-07
Identifier:(2S)-4-amino-N-{(1R,2S,3R,4R,5S)-5-amino-3-{[3-O-(2,6-diamino-2,6-dideoxy-beta-L-idopyranosyl)-beta-D-ribofuranosyl]oxy}-4-[(2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-galactopyranosyl)oxy]-2-hydroxycyclohexyl}-2-hydroxybutanamide
FJA
FJA
Name:Fusicoccin J aglycone
Formula:C21 H34 O4
SMILES:O(C)CC3C2=CC1(C(=C(C(C)C)CC1O)C(O)C(O)C(C2CC3)C)C
InChi:InChI=1S/C21H34O4/c1-11(2)15-8-17(22)21(4)9-16-13(10-25-5)6-7-14(16)12(3)19(23)20(24)18(15)21/h9,11-14,17,19-20,22-24H,6-8,10H2,1-5H3/b16-9-/t12-,13-,14+,17+,19-,20-,21+/m1/s1
Synonyms:(1S,4R,5R,6R,6aS,9S,9aE,10aR)-9-(methoxymethyl)-6,10a-dimethyl-3-(propan-2-yl)-1,2,4,5,6,6a,7,8,9,10a-decahydrodicyclop enta[a,d][8]annulene-1,4,5-triol
Definition date:2011-07-06
Last modified:2020-06-17
Identifier:(1S,4R,5R,6R,6aS,9S,9aE,10aR)-9-(methoxymethyl)-6,10a-dimethyl-3-(propan-2-yl)-1,2,4,5,6,6a,7,8,9,10a-decahydrodicyclopenta[a,d][8]annulene-1,4,5-triol

238582

건을2025-07-09부터공개중

PDB statisticsPDBj update infoContact PDBjnumon