Chemie クエリの検索結果 - 日本蛋白質構造データバンク

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PDB ウェブページステータス検索化合物検索: 36565 件 BIRD

G16

G16
表記:	1,6-di-O-phosphono-alpha-D-glucopyranose
組成式:	C6 H13 O12 P2
SMILES:	O=P([O-])(OC1OC(C(O)C(O)C1O)COP(=O)(O)O)O
InChi:	InChI=1S/C6H14O12P2/c7-3-2(1-16-19(10,11)12)17-6(5(9)4(3)8)18-20(13,14)15/h2-9H,1H2,(H2,10,11,12)(H2,13,14,15)/p-1/t2-,3-,4+,5-,6-/m1/s1
別名:	ALPHA-D-GLUCOSE 1,6-BISPHOSPHATE
定義日:	1999-08-11
最終更新日:	2020-07-17
識別子（ID）:	1-O-(hydroxyphosphinato)-6-O-phosphono-alpha-D-glucopyranose

G1P

G1P
表記:	1-O-phosphono-alpha-D-glucopyranose
組成式:	C6 H13 O9 P
SMILES:	O=P(O)(OC1OC(C(O)C(O)C1O)CO)O
InChi:	InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
別名:	ALPHA-D-GLUCOSE-1-PHOSPHATE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	1-O-phosphono-alpha-D-glucopyranose

G20

G20
表記:	5-N-acetyl-4-guanidino-6-methyl(propyl) carboxamide-4,5-dihydro-2H-pyran-2-carboxylic acid
組成式:	C14 H23 N5 O5
SMILES:	O=C(O)C=1OC(C(=O)N(CCC)C)C(NC(=O)C)C(NC(=[N@H])N)C=1
InChi:	InChI=1S/C14H23N5O5/c1-4-5-19(3)12(21)11-10(17-7(2)20)8(18-14(15)16)6-9(24-11)13(22)23/h6,8,10-11H,4-5H2,1-3H3,(H,17,20)(H,22,23)(H4,15,16,18)/t8-,10+,11+/m0/s1
別名:	4-ACETYL-4-GUANIDINO-6-METHYL(PROPYL)CARBOXAMIDE-4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	(2R,3R,4S)-3-(acetylamino)-4-carbamimidamido-2-[methyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid (non-preferred name)

G28

G28
表記:	5-N-acetyl-4-amino-6-diethyl carboxamide-4,5-dihydro-2H-pyran-2-carboxylic acid
組成式:	C13 H21 N3 O5
SMILES:	C(O)(=O)C1=CC(C(NC(=O)C)C(O1)C(=O)N(CC)CC)N
InChi:	InChI=1S/C13H21N3O5/c1-4-16(5-2)12(18)11-10(15-7(3)17)8(14)6-9(21-11)13(19)20/h6,8,10-11H,4-5,14H2,1-3H3,(H,15,17)(H,19,20)/t8-,10+,11+/m0/s1
別名:	5-N-ACETYL-4-AMINO-6-DIETHYLCARBOXAMIDE-4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	(2R,3R,4S)-3-(acetylamino)-4-amino-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid (non-preferred name)

G4S

G4S
表記:	4-O-sulfo-beta-D-galactopyranose
組成式:	C6 H12 O9 S
SMILES:	O=S(=O)(O)OC1C(OC(O)C(O)C1O)CO
InChi:	InChI=1S/C6H12O9S/c7-1-2-5(15-16(11,12)13)3(8)4(9)6(10)14-2/h2-10H,1H2,(H,11,12,13)/t2-,3-,4-,5+,6-/m1/s1
別名:	4-O-sulfo-beta-D-galactose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	4-O-sulfo-beta-D-galactopyranose

G6P

G6P
表記:	6-O-phosphono-alpha-D-glucopyranose
組成式:	C6 H13 O9 P
SMILES:	O=P(O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6+/m1/s1
別名:	ALPHA-D-GLUCOSE-6-PHOSPHATE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	6-O-phosphono-alpha-D-glucopyranose

G6S

G6S
表記:	6-O-sulfo-beta-D-galactopyranose
組成式:	C6 H12 O9 S
SMILES:	O=S(=O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H12O9S/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H,11,12,13)/t2-,3+,4+,5-,6-/m1/s1
別名:	D-GALACTOSE-6-SULFATE
定義日:	2001-01-25
最終更新日:	2020-07-17
識別子（ID）:	6-O-sulfo-beta-D-galactopyranose

G7P

G7P
表記:	6,7-dideoxy-7-phosphono-beta-D-gluco-heptopyranose
組成式:	C7 H15 O8 P
SMILES:	O=P(O)(O)CCC1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C7H15O8P/c8-4-3(1-2-16(12,13)14)15-7(11)6(10)5(4)9/h3-11H,1-2H2,(H2,12,13,14)/t3-,4-,5+,6-,7-/m1/s1
別名:	6,7-dideoxy-7-phosphono-beta-D-gluco-heptose
定義日:	2009-04-03
最終更新日:	2020-07-17
識別子（ID）:	6,7-dideoxy-7-phosphono-beta-D-gluco-heptopyranose

G8Z

G8Z
表記:	prop-2-en-1-yl 4-O-methyl-alpha-D-mannopyranoside
組成式:	C10 H18 O6
SMILES:	CO[CH]1[CH](O)[CH](O)[CH](OCC=C)O[CH]1CO
InChi:	InChI=1S/C10H18O6/c1-3-4-15-10-8(13)7(12)9(14-2)6(5-11)16-10/h3,6-13H,1,4-5H2,2H3/t6-,7-,8+,9-,10+/m1/s1
別名:	Allyl-Alpha-4-Methyl-Mannoside
定義日:	2016-01-04
最終更新日:	2020-07-17
公開日:	2017-03-29
識別子（ID）:	(2S,3S,4R,5S,6R)-6-(hydroxymethyl)-5-methoxy-2-prop-2-enoxy-oxane-3,4-diol

GAA

GAA
表記:	3-nitrophenyl alpha-D-galactopyranoside
組成式:	C12 H15 N O8
SMILES:	[O-][N+](=O)c2cc(OC1OC(C(O)C(O)C1O)CO)ccc2
InChi:	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12+/m1/s1
別名:	METANITROPHENYL-ALPHA-D-GALACTOSIDE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	3-nitrophenyl alpha-D-galactopyranoside

GAC

GAC
表記:	DIHYDRO-ACARBOSE
組成式:	C25 H45 N O18
SMILES:	O(C1C(OC(O)C(O)C1O)CO)C4OC(C(OC3OC(C)C(NC2CC(CO)C(O)C(O)C2O)C(O)C3O)C(O)C4O)CO
InChi:	InChI=1S/C25H45NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h6-39H,2-5H2,1H3/t6-,7-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23+,24-,25-/m1/s1
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	4,6-dideoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose

GAT

GAT
表記:	4-aminophenyl alpha-D-galactopyranoside
組成式:	C12 H17 N O6
SMILES:	O(c1ccc(N)cc1)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9+,10+,11-,12+/m1/s1
別名:	4'-AMINOPHENYL-ALPHA-D-GALACTOPYRANOSIDE
定義日:	2000-02-09
最終更新日:	2020-07-17
識別子（ID）:	4-aminophenyl alpha-D-galactopyranoside

GBH

GBH
表記:	2-{4-[2-(beta-D-glucopyranosyloxy)ethyl]piperazin-1-yl}ethanesulfonic acid
組成式:	C14 H28 N2 O9 S
SMILES:	O=S(=O)(O)CCN2CCN(CCOC1OC(C(O)C(O)C1O)CO)CC2
InChi:	InChI=1S/C14H28N2O9S/c17-9-10-11(18)12(19)13(20)14(25-10)24-7-5-15-1-3-16(4-2-15)6-8-26(21,22)23/h10-14,17-20H,1-9H2,(H,21,22,23)/t10-,11-,12+,13-,14-/m1/s1
別名:	2-{4-[2-(beta-D-glucosyloxy)ethyl]piperazin-1-yl}ethanesulfonic acid
定義日:	2011-10-20
最終更新日:	2020-07-17
識別子（ID）:	2-{4-[2-(beta-D-glucopyranosyloxy)ethyl]piperazin-1-yl}ethanesulfonic acid

604

604
表記:	2-[(3-bromobenzene-1-carbonyl)amino]-6-{[(4-carboxy-5-methylfuran-2-yl)sulfonyl]amino}-2,6-dideoxy-alpha-D-glucopyranos e
組成式:	C19 H21 Br N2 O10 S
SMILES:	Cc1oc(cc1C(O)=O)[S](=O)(=O)NC[CH]2O[CH](O)[CH](NC(=O)c3cccc(Br)c3)[CH](O)[CH]2O
InChi:	InChI=1S/C19H21BrN2O10S/c1-8-11(18(26)27)6-13(31-8)33(29,30)21-7-12-15(23)16(24)14(19(28)32-12)22-17(25)9-3-2-4-10(20)5-9/h2-6,12,14-16,19,21,23-24,28H,7H2,1H3,(H,22,25)(H,26,27)/t12-,14-,15-,16-,19+/m1/s1
別名:	5-[[(2~{R},3~{S},4~{R},5~{R},6~{S})-5-[(3-bromophenyl)carbonylamino]-3,4,6-tris(oxidanyl)oxan-2-yl]methylsulfamoyl]-2-m ethyl-furan-3-carboxylic acid
定義日:	2016-01-07
最終更新日:	2020-07-17
公開日:	2016-03-30
識別子（ID）:	5-[[(2~{R},3~{S},4~{R},5~{R},6~{S})-5-[(3-bromophenyl)carbonylamino]-3,4,6-tris(oxidanyl)oxan-2-yl]methylsulfamoyl]-2-m ethyl-furan-3-carboxylic acid

61J

61J
表記:	(6S)-2,6-anhydro-1-deoxy-6-(2-{[(S)-hydroxy(oxido)-lambda~5~-phosphanyl]oxy}ethyl)-D-galactitol
組成式:	C8 H17 O7 P
SMILES:	C1(C)C(C(C(C(O1)CCOP(=O)O)O)O)O
InChi:	InChI=1S/C8H17O7P/c1-4-6(9)8(11)7(10)5(15-4)2-3-14-16(12)13/h4-11,16H,2-3H2,1H3,(H,12,13)/t4-,5-,6+,7+,8+/m0/s1
定義日:	2016-01-13
最終更新日:	2020-07-17
公開日:	2016-03-02
識別子（ID）:	(6S)-2,6-anhydro-1-deoxy-6-(2-{[(S)-hydroxy(oxido)-lambda~5~-phosphanyl]oxy}ethyl)-D-galactitol

62I

62I
表記:	(6R)-1-O-acetyl-2,6-anhydro-6-{[4-(sulfamoyloxy)piperidin-1-yl]sulfonyl}-L-glucitol
組成式:	C13 H24 N2 O11 S2
SMILES:	C1(C(O)C(O)C(C(COC(=O)C)O1)O)S(=O)(=O)N2CCC(CC2)OS(=O)(=O)N
InChi:	InChI=1S/C13H24N2O11S2/c1-7(16)24-6-9-10(17)11(18)12(19)13(25-9)27(20,21)15-4-2-8(3-5-15)26-28(14,22)23/h8-13,17-19H,2-6H2,1H3,(H2,14,22,23)/t9-,10+,11-,12-,13-/m1/s1
定義日:	2015-05-21
最終更新日:	2020-07-17
公開日:	2015-08-26
識別子（ID）:	(6R)-1-O-acetyl-2,6-anhydro-6-{[4-(sulfamoyloxy)piperidin-1-yl]sulfonyl}-L-glucitol

6C2

6C2
表記:	methyl 2-acetamido-2-deoxy-beta-D-glucopyranosiduronic acid
組成式:	C9 H15 N O7
SMILES:	OC1C(OC(C(C1O)NC(=O)C)OC)C(O)=O
InChi:	InChI=1S/C9H15NO7/c1-3(11)10-4-5(12)6(13)7(8(14)15)17-9(4)16-2/h4-7,9,12-13H,1-2H3,(H,10,11)(H,14,15)/t4-,5-,6+,7+,9-/m1/s1
別名:	methyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranosiduronic acid
定義日:	2015-03-05
最終更新日:	2020-07-17
公開日:	2016-04-06
識別子（ID）:	methyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranosiduronic acid

F6P

F6P
表記:	6-O-phosphono-beta-D-fructofuranose
組成式:	C6 H13 O9 P
SMILES:	O=P(O)(O)OCC1OC(O)(CO)C(O)C1O
InChi:	InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6-/m1/s1
別名:	FRUCTOSE-6-PHOSPHATE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	6-O-phosphono-beta-D-fructofuranose

FBP

FBP
表記:	1,6-di-O-phosphono-beta-D-fructofuranose
組成式:	C6 H14 O12 P2
SMILES:	O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O
InChi:	InChI=1S/C6H14O12P2/c7-4-3(1-16-19(10,11)12)18-6(9,5(4)8)2-17-20(13,14)15/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6-/m1/s1
別名:	BETA-FRUCTOSE-1,6-DIPHOSPHATE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	1,6-di-O-phosphono-beta-D-fructofuranose

FCT

FCT
表記:	DEOXY-2-FLUORO-B-D-CELLOTRIOSIDE
組成式:	C18 H31 F O15
SMILES:	FC3C(O)C(OC2OC(C(OC1OC(CO)C(O)C(O)C1O)C(O)C2O)CO)C(OC3O)CO
InChi:	InChI=1S/C18H31FO15/c19-7-9(24)14(5(2-21)30-16(7)29)33-18-13(28)11(26)15(6(3-22)32-18)34-17-12(27)10(25)8(23)4(1-20)31-17/h4-18,20-29H,1-3H2/t4-,5-,6-,7-,8-,9-,10+,11-,12-,13-,14-,15-,16+,17+,18+/m1/s1
定義日:	1999-09-22
最終更新日:	2020-07-17
識別子（ID）:	beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-2-deoxy-2-fluoro-alpha-D-glucopyranose

FDP

FDP
表記:	2,6-di-O-phosphono-beta-D-fructofuranose
組成式:	C6 H14 O12 P2
SMILES:	O=P(OC1(OC(C(O)C1O)COP(=O)(O)O)CO)(O)O
InChi:	InChI=1S/C6H14O12P2/c7-2-6(18-20(13,14)15)5(9)4(8)3(17-6)1-16-19(10,11)12/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6+/m1/s1
別名:	FRUCTOSE-2,6-DIPHOSPHATE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2,6-di-O-phosphono-beta-D-fructofuranose

FDQ

FDQ
表記:	2,5-anhydro-1-deoxy-1-phosphono-6-O-phosphono-D-glucitol
組成式:	C6 H14 O10 P2
SMILES:	O=P(OCC1OC(C(O)C1O)CP(=O)(O)O)(O)O
InChi:	InChI=1S/C6H14O10P2/c7-5-3(1-15-18(12,13)14)16-4(6(5)8)2-17(9,10)11/h3-8H,1-2H2,(H2,9,10,11)(H2,12,13,14)/t3-,4+,5-,6-/m1/s1
別名:	D-GLUCO-2,5-ANHYDRO-1-DEOXY-1-PHOSPHONOHEXITOL-6-PHOSPHATE
定義日:	2000-04-06
最終更新日:	2020-07-17
識別子（ID）:	2,5-anhydro-1-deoxy-1-phosphono-6-O-phosphono-D-glucitol

FFC

FFC
表記:	2-DEOXY-2-FLUORO-B-D-CELLOBIOSIDE
組成式:	C12 H21 F O10
SMILES:	FC2C(O)C(OC1OC(C(O)C(O)C1O)CO)C(OC2O)CO
InChi:	InChI=1S/C12H21FO10/c13-5-7(17)10(4(2-15)21-11(5)20)23-12-9(19)8(18)6(16)3(1-14)22-12/h3-12,14-20H,1-2H2/t3-,4-,5-,6-,7-,8+,9-,10-,11+,12+/m1/s1
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-deoxy-2-fluoro-4-O-beta-D-glucopyranosyl-alpha-D-glucopyranose

EEN

EEN
表記:	2-deoxy-2-[(difluoroacetyl)amino]-alpha-D-galactopyranose
組成式:	C8 H13 F2 N O6
SMILES:	OC[CH]1O[CH](O)[CH](NC(=O)C(F)F)[CH](O)[CH]1O
InChi:	InChI=1S/C8H13F2NO6/c9-6(10)7(15)11-3-5(14)4(13)2(1-12)17-8(3)16/h2-6,8,12-14,16H,1H2,(H,11,15)/t2-,3-,4+,5-,8+/m1/s1
別名:	N-DIFLUOROACETYL-D-GALACTOSAMINE
定義日:	2018-03-16
最終更新日:	2020-07-17
公開日:	2019-02-20
識別子（ID）:	2,2-bis(fluoranyl)-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide

EEQ

EEQ
表記:	2-deoxy-2-[(fluoroacetyl)amino]-alpha-D-galactopyranose
組成式:	C8 H14 F N O6
SMILES:	OC[CH]1O[CH](O)[CH](NC(=O)CF)[CH](O)[CH]1O
InChi:	InChI=1S/C8H14FNO6/c9-1-4(12)10-5-7(14)6(13)3(2-11)16-8(5)15/h3,5-8,11,13-15H,1-2H2,(H,10,12)/t3-,5-,6+,7-,8+/m1/s1
別名:	2-fluoranyl-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide
定義日:	2018-03-16
最終更新日:	2020-07-17
公開日:	2019-02-20
識別子（ID）:	2-fluoranyl-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide

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