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PDB ウェブページステータス検索化合物検索: 35455 件 BIRD

XIL

XIL
表記:	(3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside
組成式:	C10 H17 N O7
SMILES:	O=C2NCCC(OC1OCC(O)C(O)C1O)C2O
InChi:	InChI=1S/C10H17NO7/c12-4-3-17-10(8(15)6(4)13)18-5-1-2-11-9(16)7(5)14/h4-8,10,12-15H,1-3H2,(H,11,16)/t4-,5-,6+,7+,8-,10+/m1/s1
別名:	3-HYDROXY-4-(3,4,5-TRIHYDROXY-TETRAHYDRO-PYRAN-2-YLOXY)-PIPERIDIN-2-ONE
定義日:	2002-10-28
最終更新日:	2020-07-17
識別子（ID）:	(3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside

XLS

XLS
表記:	D-xylose
組成式:	C5 H10 O5
SMILES:	O=CC(O)C(O)C(O)CO
InChi:	InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4+,5+/m0/s1
別名:	D-XYLOSE (LINEAR FORM)
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	D-xylose

XMM

XMM
表記:	5-bromo-4-chloro-1H-indol-3-yl alpha-D-mannopyranoside
組成式:	C14 H15 Br Cl N O6
SMILES:	Brc3ccc2c(c(OC1OC(C(O)C(O)C1O)CO)cn2)c3Cl
InChi:	InChI=1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13+,14+/m1/s1
別名:	(2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO-1H-INDOL-3-YLOXY)-TETRAHYDRO-6-(HYDROXYMETHYL)-2H-PYRAN-3,4,5-TRIOL
定義日:	2005-04-26
最終更新日:	2020-07-17
識別子（ID）:	5-bromo-4-chloro-1H-indol-3-yl alpha-D-mannopyranoside

NNG

NNG
表記:	2-deoxy-2-{[(S)-hydroxy(methyl)phosphoryl]amino}-6-O-phosphono-alpha-D-glucopyranose
組成式:	C7 H17 N O10 P2
SMILES:	O=P(O)(O)OCC1OC(O)C(NP(=O)(O)C)C(O)C1O
InChi:	InChI=1S/C7H17NO10P2/c1-19(12,13)8-4-6(10)5(9)3(18-7(4)11)2-17-20(14,15)16/h3-7,9-11H,2H2,1H3,(H2,8,12,13)(H2,14,15,16)/t3-,4-,5-,6-,7+/m1/s1
別名:	N-ACETYLPHOSPHONOAMIDATE-D-GLUCOSAMINE-6-PHOSPHATE
定義日:	2007-03-26
最終更新日:	2020-07-17
識別子（ID）:	2-deoxy-2-{[(S)-hydroxy(methyl)phosphoryl]amino}-6-O-phosphono-alpha-D-glucopyranose

NPF

NPF
表記:	2-nitrophenyl beta-D-fucopyranoside
組成式:	C12 H15 N O7
SMILES:	[O-][N+](=O)c2c(OC1OC(C(O)C(O)C1O)C)cccc2
InChi:	InChI=1S/C12H15NO7/c1-6-9(14)10(15)11(16)12(19-6)20-8-5-3-2-4-7(8)13(17)18/h2-6,9-12,14-16H,1H3/t6-,9+,10+,11-,12+/m1/s1
別名:	ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE
定義日:	2000-02-08
最終更新日:	2020-07-17
識別子（ID）:	2-nitrophenyl 6-deoxy-beta-D-galactopyranoside

NSQ

NSQ
表記:	4-nitrophenyl alpha-D-6-sulfoquinovoside
組成式:	C12 H15 N O10 S
SMILES:	O[CH]1[CH](O)[CH](C[S](O)(=O)=O)O[CH](Oc2ccc(cc2)[N+]([O-])=O)[CH]1O
InChi:	InChI=1S/C12H15NO10S/c14-9-8(5-24(19,20)21)23-12(11(16)10(9)15)22-7-3-1-6(2-4-7)13(17)18/h1-4,8-12,14-16H,5H2,(H,19,20,21)/t8-,9-,10+,11-,12+/m1/s1
別名:	4-NITROPHENYL-ALPHA-D-SULFOQUINOVOSIDE
定義日:	2015-08-28
最終更新日:	2020-07-17
公開日:	2016-02-10
識別子（ID）:	[(2S,3S,4S,5R,6R)-6-(4-nitrophenoxy)-3,4,5-tris(oxidanyl)oxan-2-yl]methanesulfonic acid

NTF

NTF
表記:	N-(trifluoroacetyl)-beta-D-glucopyranosylamine
組成式:	C8 H12 F3 N O6
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C(F)(F)F
InChi:	InChI=1S/C8H12F3NO6/c9-8(10,11)7(17)12-6-5(16)4(15)3(14)2(1-13)18-6/h2-6,13-16H,1H2,(H,12,17)/t2-,3-,4+,5-,6-/m1/s1
別名:	N-TRIFLURO-ACETYL-BETA-D-GLUCOPYRANOSYLAMINE
定義日:	2005-01-12
最終更新日:	2020-07-17
識別子（ID）:	N-(trifluoroacetyl)-beta-D-glucopyranosylamine

NYT

NYT
表記:	beta-D-fructofuranosyl-(2->1)-beta-D-fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside
組成式:	C24 H42 O21
SMILES:	OC[CH]1O[CH](O[C]2(CO[C]3(CO[C]4(CO)O[CH](CO)[CH](O)[CH]4O)O[CH](CO)[CH](O)[CH]3O)O[CH](CO)[CH](O)[CH]2O)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C24H42O21/c25-1-8-12(30)16(34)17(35)21(41-8)45-24(20(38)15(33)11(4-28)44-24)7-40-23(19(37)14(32)10(3-27)43-23)6-39-22(5-29)18(36)13(31)9(2-26)42-22/h8-21,25-38H,1-7H2/t8-,9-,10-,11-,12-,13-,14-,15-,16+,17-,18+,19+,20+,21-,22-,23-,24+/m1/s1
別名:	Nystose
定義日:	2010-02-15
最終更新日:	2020-07-17
識別子（ID）:	(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-2-[[(2R,3S,4S,5R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

O1G

O1G
表記:	3-deoxy-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-6-O-phosphono-alpha-D-gluco pyranose
組成式:	C14 H22 N2 O13 P2
SMILES:	O=P(O)(O)OCc1cnc(c(O)c1/C=N/C2C(O)C(OC(O)C2O)COP(=O)(O)O)C
InChi:	InChI=1S/C14H22N2O13P2/c1-6-11(17)8(7(2-15-6)4-27-30(21,22)23)3-16-10-12(18)9(5-28-31(24,25)26)29-14(20)13(10)19/h2-3,9-10,12-14,17-20H,4-5H2,1H3,(H2,21,22,23)(H2,24,25,26)/b16-3+/t9-,10+,12-,13-,14+/m1/s1
別名:	3-deoxy-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-6-O-phosphono-alpha-D-gluco se
定義日:	2013-04-10
最終更新日:	2020-07-17
公開日:	2013-10-16
識別子（ID）:	3-deoxy-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-6-O-phosphono-alpha-D-gluco pyranose

XS2

XS2
表記:	METHYL4,4II,4III,4IV-TETRATHIO-BETA-D-XYLOPENTOSIDE
組成式:	C26 H44 O17 S4
SMILES:	S(C2COC(SC1C(O)C(O)C(OC)OC1)C(O)C2O)C5OCC(SC4OCC(SC3OCC(O)C(O)C3O)C(O)C4O)C(O)C5O
InChi:	InChI=1S/C26H44O17S4/c1-38-22-17(33)13(29)8(3-39-22)44-24-19(35)15(31)10(5-41-24)46-26-21(37)16(32)11(6-43-26)47-25-20(36)14(30)9(4-42-25)45-23-18(34)12(28)7(27)2-40-23/h7-37H,2-6H2,1H3/t7?,8-,9?,10-,11-,12?,13+,14?,15+,16+,17-,18?,19-,20?,21-,22+,23?,24+,25?,26+/m1/s1
定義日:	2004-10-14
最終更新日:	2020-07-17
識別子（ID）:	methyl pentopyranosyl-(1->4)-4-thiopentopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-alpha-D-xylopyranoside

XVR

XVR
表記:	(5S)-5-[(6R)-6-hydroxy-6-methyl-5-oxooctyl]furan-2(5H)-one
組成式:	C13 H20 O4
SMILES:	O=C(CCCCC1OC(C=C1)=O)C(CC)(C)O
InChi:	InChI=1S/C13H20O4/c1-3-13(2,16)11(14)7-5-4-6-10-8-9-12(15)17-10/h8-10,16H,3-7H2,1-2H3/t10-,13+/m0/s1
定義日:	2020-04-29
最終更新日:	2020-07-17
公開日:	2020-07-22
識別子（ID）:	(5S)-5-[(6R)-6-hydroxy-6-methyl-5-oxooctyl]furan-2(5H)-one

XXM

XXM
表記:	3-C-(hydroxylmethyl)-alpha-D-erythrofuranose
組成式:	C5 H10 O5
SMILES:	OCC1(C(C(OC1)O)O)O
InChi:	InChI=1S/C5H10O5/c6-1-5(9)2-10-4(8)3(5)7/h3-4,6-9H,1-2H2/t3-,4-,5+/m0/s1
別名:	alpha-D-apiose
定義日:	2016-02-24
最終更新日:	2020-07-17
公開日:	2016-04-20
識別子（ID）:	(2S,3R,4R)-4-(hydroxymethyl)oxolane-2,3,4-triol

XXR

XXR
表記:	alpha-D-rhamnopyranose
組成式:	C6 H12 O5
SMILES:	OC1C(O)C(OC(O)C1O)C
InChi:	InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5+,6+/m1/s1
別名:	alpha-D-rhamnose
定義日:	2013-07-18
最終更新日:	2020-07-17
公開日:	2014-02-19
識別子（ID）:	6-deoxy-alpha-D-mannopyranose

XYF

XYF
表記:	5(R)-fluoro-beta-D-xylopyranose
組成式:	C5 H8 F O5
SMILES:	[O-]C1OC(F)C(O)C(O)C1O
InChi:	InChI=1S/C5H8FO5/c6-4-2(8)1(7)3(9)5(10)11-4/h1-5,7-9H/q-1/t1-,2-,3+,4-,5?/m0/s1
別名:	5(R)-fluoro-beta-D-xylose
定義日:	2004-10-23
最終更新日:	2020-07-17
識別子（ID）:	(2R,3R,4R,5S,6R)-6-fluoro-3,4,5-trihydroxytetrahydro-2H-pyran-2-olate (non-preferred name)

XYS

XYS
表記:	alpha-D-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+/m1/s1
別名:	alpha-D-xylose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	alpha-D-xylopyranose

XYT

XYT
表記:	Cellobiose-6-phosphate
組成式:	C12 H23 O14 P
SMILES:	OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O[CH]2O[CH](CO[P](O)(O)=O)[CH](O)[CH](O)[CH]2O
InChi:	InChI=1S/C12H23O14P/c13-1-3-10(7(16)8(17)11(19)24-3)26-12-9(18)6(15)5(14)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)/t3-,4-,5-,6+,7-,8-,9-,10-,11-,12+/m1/s1
定義日:	2017-07-25
最終更新日:	2020-07-17
公開日:	2017-10-18
識別子（ID）:	[(2~{R},3~{S},4~{S},5~{R},6~{S})-6-[(2~{R},3~{S},4~{R},5~{R},6~{R})-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate

XYZ

XYZ
表記:	beta-D-xylofuranose
組成式:	C5 H10 O5
SMILES:	OC1C(OC(O)C1O)CO
InChi:	InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3+,4-,5-/m1/s1
別名:	beta-D-xylose
定義日:	2004-06-10
最終更新日:	2020-07-17
識別子（ID）:	beta-D-xylofuranose

YDR

YDR
表記:	6-S-alpha-D-mannopyranosyl-6-thio-alpha-D-mannopyranose
組成式:	C12 H22 O10 S
SMILES:	S(CC1OC(O)C(O)C(O)C1O)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C12H22O10S/c13-1-3-5(14)8(17)10(19)12(22-3)23-2-4-6(15)7(16)9(18)11(20)21-4/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11+,12-/m1/s1
定義日:	2011-02-24
最終更新日:	2020-07-17
識別子（ID）:	6-S-alpha-D-mannopyranosyl-6-thio-alpha-D-mannopyranose

YIO

YIO
表記:	1-thio-beta-D-galactopyranose
組成式:	C6 H12 O5 S
SMILES:	OC[CH]1O[CH](S)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C6H12O5S/c7-1-2-3(8)4(9)5(10)6(12)11-2/h2-10,12H,1H2/t2-,3+,4+,5-,6+/m1/s1
別名:	(2R,3R,4S,5R,6S)-2-(HYDROXYMETHYL)-6-SULFANYL-OXANE-3,4,5-TRIOL
定義日:	2011-05-16
最終更新日:	2020-07-17
識別子（ID）:	(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-sulfanyl-oxane-3,4,5-triol

YKR

YKR
表記:	2-amino-4-O-benzyl-2-deoxy-alpha-D-glucopyranose
組成式:	C13 H19 N O5
SMILES:	OC2C(OCc1ccccc1)C(OC(O)C2N)CO
InChi:	InChI=1S/C13H19NO5/c14-10-11(16)12(9(6-15)19-13(10)17)18-7-8-4-2-1-3-5-8/h1-5,9-13,15-17H,6-7,14H2/t9-,10-,11-,12-,13+/m1/s1
別名:	4-benzyl-alpha-D-glucosamine
定義日:	2012-07-31
最終更新日:	2020-07-17
公開日:	2013-08-07
識別子（ID）:	2-amino-4-O-benzyl-2-deoxy-alpha-D-glucopyranose

YO5

YO5
表記:	(1R)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol
組成式:	C7 H15 O8 P
SMILES:	O=P(O)(O)CC1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C7H15O8P/c8-1-3-5(9)7(11)6(10)4(15-3)2-16(12,13)14/h3-11H,1-2H2,(H2,12,13,14)/t3-,4+,5-,6+,7+/m1/s1
別名:	Beta-1 phosphonomethylene-D-glucopyranose
定義日:	2013-09-09
最終更新日:	2020-07-17
公開日:	2014-07-16
識別子（ID）:	(1R)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol

YX0

YX0
表記:	[(3E)-3-(1-hydroxyethylidene)-2,3-dihydroisoxazol-5-yl]methyl alpha-L-fucopyranoside
組成式:	C12 H19 N O7
SMILES:	O(CC=1ONC(=C(O)C)C=1)C2OC(C(O)C(O)C2O)C
InChi:	InChI=1S/C12H19NO7/c1-5(14)8-3-7(20-13-8)4-18-12-11(17)10(16)9(15)6(2)19-12/h3,6,9-17H,4H2,1-2H3/b8-5+/t6-,9+,10+,11-,12+/m0/s1
別名:	[(3E)-3-(1-hydroxyethylidene)-2,3-dihydroisoxazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside
定義日:	2008-05-22
最終更新日:	2020-07-17
識別子（ID）:	[(3E)-3-(1-hydroxyethylidene)-2,3-dihydroisoxazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside

YX1

YX1
表記:	2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucopyranose
組成式:	C8 H17 N3 O7
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)N(NO)C
InChi:	InChI=1S/C8H17N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,10,12-15,17H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7-/m1/s1
別名:	2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucose
定義日:	2008-05-29
最終更新日:	2020-07-17
識別子（ID）:	2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucopyranose

YYH

YYH
表記:	7-deoxy-L-glycero-alpha-D-manno-heptopyranose
組成式:	C7 H14 O6
SMILES:	OC1C(O)C(OC(O)C1O)C(O)C
InChi:	InChI=1S/C7H14O6/c1-2(8)6-4(10)3(9)5(11)7(12)13-6/h2-12H,1H3/t2-,3-,4-,5-,6+,7-/m0/s1
定義日:	2012-12-17
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	7-deoxy-L-glycero-alpha-D-manno-heptopyranose

YYK

YYK
表記:	beta-D-quinovopyranose
組成式:	C6 H12 O5
SMILES:	OC1C(O)C(OC(O)C1O)C
InChi:	InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5-,6-/m1/s1
別名:	beta-D-quinovoose
定義日:	2012-12-18
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	6-deoxy-beta-D-glucopyranose

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