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: 899 件 BIRD

LXB

LXB
表記:	2-acetamido-2-deoxy-beta-D-gulopyranose
組成式:	C8 H15 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:	InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6+,7+,8-/m1/s1
別名:	N-acetyl-beta-D-gulosamine
定義日:	2008-07-23
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-beta-D-gulopyranose

LXC

LXC
表記:	beta-L-xylopyranose
組成式:	C5 H10 O5
SMILES:	OC1C(O)COC(O)C1O
InChi:	InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4-,5-/m0/s1
別名:	beta-L-xylose
定義日:	2002-03-13
最終更新日:	2020-07-17
識別子（ID）:	beta-L-xylopyranose

LXZ

LXZ
表記:	2-acetamido-2-deoxy-alpha-D-idopyranose
組成式:	C8 H15 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:	InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6+,7+,8+/m1/s1
別名:	N-acetyl-alpha-D-idosamine
定義日:	2008-07-09
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-alpha-D-idopyranose

1X4

1X4
表記:	2,3-dideoxy-5-O-phosphono-alpha-D-ribofuranose
組成式:	C5 H11 O6 P
SMILES:	O=P(OCC1OC(O)CC1)(O)O
InChi:	InChI=1S/C5H11O6P/c6-5-2-1-4(11-5)3-10-12(7,8)9/h4-6H,1-3H2,(H2,7,8,9)/t4-,5-/m0/s1
別名:	2,3-dideoxyribose-5-phosphate
定義日:	2013-07-22
最終更新日:	2020-07-17
公開日:	2013-07-31
識別子（ID）:	[(2S,5S)-5-hydroxytetrahydrofuran-2-yl]methyl dihydrogen phosphate

LZ0

LZ0
表記:	[1-(2-oxoethyl)-1H-1,2,3-triazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside
組成式:	C11 H17 N3 O6
SMILES:	O=CCn1nncc1COC2OC(C(O)C(O)C2O)C
InChi:	InChI=1S/C11H17N3O6/c1-6-8(16)9(17)10(18)11(20-6)19-5-7-4-12-13-14(7)2-3-15/h3-4,6,8-11,16-18H,2,5H2,1H3/t6-,8+,9+,10-,11+/m0/s1
別名:	[1-(2-oxoethyl)-1H-1,2,3-triazol-5-yl]methyl 6-deoxy-alpha-L-galactoside
定義日:	2008-05-22
最終更新日:	2020-07-17
識別子（ID）:	[1-(2-oxoethyl)-1H-1,2,3-triazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside

M1P

M1P
表記:	1-O-phosphono-alpha-D-mannopyranose
組成式:	C6 H13 O9 P
SMILES:	O=P(OC1OC(C(O)C(O)C1O)CO)(O)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-MANNOSE 1-PHOSPHATE
定義日:	2003-05-22
最終更新日:	2020-07-17
識別子（ID）:	1-O-phosphono-alpha-D-mannopyranose

20X

20X
表記:	N-({(2E)-2-[(4-fluorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
組成式:	C14 H18 F N3 O5 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(F)cc2
InChi:	InChI=1S/C14H18FN3O5S/c15-8-3-1-7(2-4-8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
別名:	4-fluorobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone
定義日:	2010-04-30
最終更新日:	2020-07-17
識別子（ID）:	N-{[(2E)-2-(4-fluorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

M2F

M2F
表記:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-mannopyranoside
組成式:	C12 H13 F N2 O9
SMILES:	[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1F)CO)c([N+]([O-])=O)c2
InChi:	InChI=1S/C12H13FN2O9/c13-9-11(18)10(17)8(4-16)24-12(9)23-7-2-1-5(14(19)20)3-6(7)15(21)22/h1-3,8-12,16-18H,4H2/t8-,9+,10-,11-,12-/m1/s1
別名:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-mannoside
定義日:	2009-03-02
最終更新日:	2020-07-17
識別子（ID）:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-mannopyranoside

M3N

M3N
表記:	4-(hydroxymethyl)-1-(alpha-D-mannopyranosyl)-1H-1,2,3-triazole
組成式:	C9 H15 N3 O6
SMILES:	n1nn(cc1CO)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C9H15N3O6/c13-2-4-1-12(11-10-4)9-8(17)7(16)6(15)5(3-14)18-9/h1,5-9,13-17H,2-3H2/t5-,6-,7+,8+,9+/m1/s1
別名:	4-(hydroxymethyl)-1-(alpha-D-mannosyl)-1H-1,2,3-triazole
定義日:	2014-05-02
最終更新日:	2020-07-17
公開日:	2014-12-17
識別子（ID）:	4-(hydroxymethyl)-1-(alpha-D-mannopyranosyl)-1H-1,2,3-triazole

A0K

A0K
表記:	1,3-dihydroxypropan-2-yl alpha-D-glucopyranoside
組成式:	C9 H18 O8
SMILES:	OCC(CO)O[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C9H18O8/c10-1-4(2-11)16-9-8(15)7(14)6(13)5(3-12)17-9/h4-15H,1-3H2/t5-,6-,7+,8-,9+/m1/s1
別名:	(2~{S},3~{R},4~{S},5~{S},6~{R})-2-[1,3-bis(oxidanyl)propan-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
定義日:	2017-08-08
最終更新日:	2020-07-17
公開日:	2018-08-29
識別子（ID）:	(2~{S},3~{R},4~{S},5~{S},6~{R})-2-[1,3-bis(oxidanyl)propan-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol

A1Q

A1Q
表記:	methyl L-glycero-alpha-D-manno-heptopyranoside
組成式:	C8 H16 O7
SMILES:	OC1C(O)C(O)C(OC1OC)C(O)CO
InChi:	InChI=1S/C8H16O7/c1-14-8-6(13)4(11)5(12)7(15-8)3(10)2-9/h3-13H,2H2,1H3/t3-,4-,5-,6-,7+,8-/m0/s1
別名:	ALPHA-METHYL HEPTOPYRANOSE
定義日:	2012-03-26
最終更新日:	2020-07-17
識別子（ID）:	methyl (5R)-5-[(1S)-1,2-dihydroxyethyl]-alpha-D-lyxopyranoside

M55

M55
表記:	benzyl alpha-D-glucopyranuronate
組成式:	C13 H16 O7
SMILES:	O[CH]1O[CH]([CH](O)[CH](O)[CH]1O)C(=O)OCc2ccccc2
InChi:	InChI=1S/C13H16O7/c14-8-9(15)11(20-12(17)10(8)16)13(18)19-6-7-4-2-1-3-5-7/h1-5,8-12,14-17H,6H2/t8-,9-,10+,11-,12-/m0/s1
別名:	Benzyl D-glucuronoate
定義日:	2019-10-03
最終更新日:	2020-07-17
公開日:	2019-11-27
識別子（ID）:	(phenylmethyl) (2~{S},3~{S},4~{S},5~{R},6~{S})-3,4,5,6-tetrakis(oxidanyl)oxane-2-carboxylate

A2G

A2G
表記:	2-acetamido-2-deoxy-alpha-D-galactopyranose
組成式:	C8 H15 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:	InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6+,7-,8+/m1/s1
別名:	N-acetyl-alpha-D-galactosamine
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-alpha-D-galactopyranose

M6D

M6D
表記:	6-O-phosphono-beta-D-mannopyranose
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:	beta-D-mannose-6-phosphate
定義日:	2007-11-21
最終更新日:	2020-07-17
識別子（ID）:	6-O-phosphono-beta-D-mannopyranose

M6P

M6P
表記:	6-O-phosphono-alpha-D-mannopyranose
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-MANNOSE-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-mannopyranose

M7B

M7B
表記:	7-O-phosphono-D-glycero-beta-D-manno-heptopyranose
組成式:	C7 H15 O10 P
SMILES:	O=P(O)(O)OCC(O)C1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C7H15O10P/c8-2(1-16-18(13,14)15)6-4(10)3(9)5(11)7(12)17-6/h2-12H,1H2,(H2,13,14,15)/t2-,3+,4+,5+,6-,7-/m1/s1
別名:	7-O-phosphono-D-glycero-beta-D-manno-heptose
定義日:	2012-04-04
最終更新日:	2020-07-17
公開日:	2012-12-21
識別子（ID）:	7-O-phosphono-D-glycero-beta-D-manno-heptopyranose

M7P

M7P
表記:	7-O-phosphono-D-glycero-alpha-D-manno-heptopyranose
組成式:	C7 H15 O10 P
SMILES:	O=P(O)(O)OCC(O)C1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C7H15O10P/c8-2(1-16-18(13,14)15)6-4(10)3(9)5(11)7(12)17-6/h2-12H,1H2,(H2,13,14,15)/t2-,3+,4+,5+,6-,7+/m1/s1
別名:	D-GLYCERO-D-MANNOPYRANOSE-7-PHOSPHATE
定義日:	2004-08-20
最終更新日:	2020-07-17
識別子（ID）:	7-O-phosphono-D-glycero-alpha-D-manno-heptopyranose

M8C

M8C
表記:	methyl alpha-D-galactopyranuronate
組成式:	C7 H12 O7
SMILES:	O=C(OC)C1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C7H12O7/c1-13-7(12)5-3(9)2(8)4(10)6(11)14-5/h2-6,8-11H,1H3/t2-,3+,4+,5-,6-/m0/s1
別名:	ALPHA-D-GALACTOPYRANURONIC METHYL ESTER
定義日:	2006-11-15
最終更新日:	2020-07-17
識別子（ID）:	methyl alpha-D-galactopyranuronate

A5C

A5C
表記:	alpha-L-talofuranose
組成式:	C6 H12 O6
SMILES:	OC1C(OC(O)C1O)C(O)CO
InChi:	InChI=1S/C6H12O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-11H,1H2/t2-,3-,4+,5+,6+/m0/s1
別名:	alpha-L-talose
定義日:	2011-03-19
最終更新日:	2020-07-17
識別子（ID）:	alpha-L-talofuranose

MA1

MA1
表記:	1,4-dithio-alpha-D-glucopyranose
組成式:	C6 H12 O4 S2
SMILES:	OC1C(S)C(OC(S)C1O)CO
InChi:	InChI=1S/C6H12O4S2/c7-1-2-5(11)3(8)4(9)6(12)10-2/h2-9,11-12H,1H2/t2-,3-,4-,5-,6-/m1/s1
別名:	1,4-dithio-alpha-D-glucose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	1,4-dithio-alpha-D-glucopyranose

A6P

A6P
表記:	6-O-phosphono-alpha-D-allopyranose
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:	6-O-phosphono-alpha-D-allose
定義日:	2008-06-10
最終更新日:	2020-07-17
識別子（ID）:	6-O-phosphono-alpha-D-allopyranose

MA2

MA2
表記:	4-S-methyl-4-thio-alpha-D-glucopyranose
組成式:	C7 H14 O5 S
SMILES:	OC1C(SC)C(OC(O)C1O)CO
InChi:	InChI=1S/C7H14O5S/c1-13-6-3(2-8)12-7(11)5(10)4(6)9/h3-11H,2H2,1H3/t3-,4-,5-,6-,7+/m1/s1
別名:	4-S-methyl-4-thio-alpha-D-glucose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	4-S-methyl-4-thio-alpha-D-glucopyranose

MA3

MA3
表記:	methyl 4-thio-alpha-D-glucopyranoside
組成式:	C7 H14 O5 S
SMILES:	OC1C(O)C(S)C(OC1OC)CO
InChi:	InChI=1S/C7H14O5S/c1-11-7-5(10)4(9)6(13)3(2-8)12-7/h3-10,13H,2H2,1H3/t3-,4-,5-,6-,7+/m1/s1
別名:	O1-METHYL-4-DEOXY-4-THIO-ALPHA-D-GLUCOSE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	methyl 4-thio-alpha-D-glucopyranoside

MA8

MA8
表記:	(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranoside
組成式:	C15 H28 N2 O11 S
SMILES:	O=C(NC2C(O)C(O)C(OC2OC1C(O)C(O)C(O)C(O)C1O)CO)C(N)CS
InChi:	InChI=1S/C15H28N2O11S/c16-3(2-29)14(26)17-5-7(20)6(19)4(1-18)27-15(5)28-13-11(24)9(22)8(21)10(23)12(13)25/h3-13,15,18-25,29H,1-2,16H2,(H,17,26)/t3-,4+,5+,6+,7+,8-,9-,10+,11+,12+,13-,15+/m0/s1
別名:	(2S,3R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXYL 2-(L-CYSTEINYLAMINO)-2-DEOXY-ALPHA-L-GLUCOPYRANOSIDE
定義日:	2005-09-26
最終更新日:	2020-07-17
識別子（ID）:	(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranoside

MAF

MAF
表記:	2-deoxy-2-fluoro-alpha-D-mannopyranose
組成式:	C6 H11 F O5
SMILES:	FC1C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3+,4-,5-,6-/m1/s1
別名:	2-DEOXY-2-FLUORO-ALPHA-D-MANNOSE
定義日:	2002-02-28
最終更新日:	2020-07-17
識別子（ID）:	2-deoxy-2-fluoro-alpha-D-mannopyranose

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