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PDB ウェブページステータス検索化合物検索: 856 件 BIRD

YYM

YYM
表記:	alpha-D-ribopyranose
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-ribose
定義日:	2012-12-17
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	alpha-D-ribopyranose

NBX

NBX
表記:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
組成式:	C14 H19 N3 O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ccc(N)cc2
InChi:	InChI=1S/C14H19N3O7/c15-7-3-1-6(2-4-7)12(22)16-14(23)17-13-11(21)10(20)9(19)8(5-18)24-13/h1-4,8-11,13,18-21H,5,15H2,(H2,16,17,22,23)/t8-,9-,10+,11-,13-/m1/s1
別名:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucosylamine
定義日:	2008-02-13
最終更新日:	2020-07-17
識別子（ID）:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine

YZ0

YZ0
表記:	methyl beta-D-mannopyranoside
組成式:	C7 H14 O6
SMILES:	OC1C(O)C(O)C(OC1OC)CO
InChi:	InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5+,6+,7-/m1/s1
定義日:	2012-12-18
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	methyl beta-D-mannopyranoside

NBY

NBY
表記:	N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
組成式:	C14 H17 N3 O9
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ccc([N+]([O-])=O)cc2
InChi:	InChI=1S/C14H17N3O9/c18-5-8-9(19)10(20)11(21)13(26-8)16-14(23)15-12(22)6-1-3-7(4-2-6)17(24)25/h1-4,8-11,13,18-21H,5H2,(H2,15,16,22,23)/t8-,9-,10+,11-,13-/m1/s1
別名:	N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucosylamine
定義日:	2008-02-13
最終更新日:	2020-07-17
識別子（ID）:	N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine

SOE

SOE
表記:	alpha-L-sorbopyranose
組成式:	C6 H12 O6
SMILES:	OC1C(O)(OCC(O)C1O)CO
InChi:	InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4+,5-,6+/m0/s1
別名:	alpha-L-sorbose
定義日:	2010-05-14
最終更新日:	2020-07-17
識別子（ID）:	alpha-L-sorbopyranose

TW7

TW7
表記:	2-deoxy-2,2-difluoro-alpha-D-arabino-hexopyranosyl fluoride
組成式:	C6 H9 F3 O4
SMILES:	C1(F)C(F)(F)C(C(O)C(O1)CO)O
InChi:	InChI=1S/C6H9F3O4/c7-5-6(8,9)4(12)3(11)2(1-10)13-5/h2-5,10-12H,1H2/t2-,3-,4+,5+/m1/s1
定義日:	2020-04-01
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	2-deoxy-2,2-difluoro-alpha-D-arabino-hexopyranosyl fluoride

SOG

SOG
表記:	octyl 1-thio-beta-D-glucopyranoside
組成式:	C14 H28 O5 S
SMILES:	S(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C14H28O5S/c1-2-3-4-5-6-7-8-20-14-13(18)12(17)11(16)10(9-15)19-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14+/m1/s1
別名:	2-HYDROXYMETHYL-6-OCTYLSULFANYL-TETRAHYDRO-PYRAN-3,4,5-TRIOL
定義日:	2003-01-21
最終更新日:	2020-07-17
識別子（ID）:	octyl 1-thio-beta-D-glucopyranoside

TWA

TWA
表記:	2,3,4-tri-O-sulfo-beta-D-altropyranose
組成式:	C6 H12 O15 S3
SMILES:	C(C1OC(C(OS(O)(=O)=O)C(C1OS(O)(=O)=O)OS(=O)(=O)O)O)O
InChi:	InChI=1S/C6H12O15S3/c7-1-2-3(19-22(9,10)11)4(20-23(12,13)14)5(6(8)18-2)21-24(15,16)17/h2-8H,1H2,(H,9,10,11)(H,12,13,14)(H,15,16,17)/t2-,3-,4-,5+,6-/m1/s1
定義日:	2020-04-01
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	2,3,4-tri-O-sulfo-beta-D-altropyranose

R1P

R1P
表記:	1-O-phosphono-alpha-D-ribofuranose
組成式:	C5 H11 O8 P
SMILES:	O=P(OC1OC(C(O)C1O)CO)(O)O
InChi:	InChI=1S/C5H11O8P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1
別名:	RIBOSE-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-ribofuranose

TWD

TWD
表記:	2,3-di-O-sulfo-alpha-L-glucopyranose
組成式:	C6 H12 O12 S2
SMILES:	C(C1C(C(C(C(O1)O)OS(O)(=O)=O)OS(=O)(O)=O)O)O
InChi:	InChI=1S/C6H12O12S2/c7-1-2-3(8)4(17-19(10,11)12)5(6(9)16-2)18-20(13,14)15/h2-9H,1H2,(H,10,11,12)(H,13,14,15)/t2-,3-,4+,5-,6+/m0/s1
定義日:	2020-04-01
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	2,3-di-O-sulfo-alpha-L-glucopyranose

TWJ

TWJ
表記:	1-thio-beta-D-talopyranose
組成式:	C6 H12 O5 S
SMILES:	SC1OC(CO)C(C(O)C1O)O
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
定義日:	2020-04-01
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	1-thio-beta-D-talopyranose

XGP

XGP
表記:	1-O-phosphono-beta-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:	1-O-phosphono-beta-D-glucose
定義日:	2009-10-07
最終更新日:	2020-07-17
識別子（ID）:	1-O-phosphono-beta-D-glucopyranose

R1X

R1X
表記:	1,4-anhydro-D-ribitol
組成式:	C5 H10 O4
SMILES:	OCC1OCC(O)C1O
InChi:	InChI=1S/C5H10O4/c6-1-4-5(8)3(7)2-9-4/h3-8H,1-2H2/t3-,4+,5-/m0/s1
別名:	1-deoxyribose
定義日:	2008-10-03
最終更新日:	2020-07-17
識別子（ID）:	1,4-anhydro-D-ribitol

SOR

SOR
表記:	sorbitol
組成式:	C6 H14 O6
SMILES:	OC(C(O)CO)C(O)C(O)CO
InChi:	InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6-/m1/s1
別名:	D-sorbitol
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	D-glucitol

X0X

X0X
表記:	beta-D-talopyranuronic acid
組成式:	C6 H10 O7
SMILES:	O=C(O)C1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2+,3-,4-,6+/m0/s1
別名:	beta-D-taluronic acid
定義日:	2015-03-30
最終更新日:	2020-07-17
公開日:	2015-12-23
識別子（ID）:	beta-D-talopyranuronic acid

Z0F

Z0F
表記:	alpha-L-idopyranose
組成式:	C6 H12 O6
SMILES:	OC1C(O)C(OC(O)C1O)CO
InChi:	InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4-,5+,6+/m0/s1
別名:	alpha-L-idose
定義日:	2012-12-18
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	alpha-L-idopyranose

MJJ

MJJ
表記:	methyl 9-O-acetyl-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
組成式:	C14 H23 N O10
SMILES:	OC1C(NC(C)=O)C(OC(C1)(C(O)=O)OC)C(C(O)COC(=O)C)O
InChi:	InChI=1S/C14H23NO10/c1-6(16)15-10-8(18)4-14(23-3,13(21)22)25-12(10)11(20)9(19)5-24-7(2)17/h8-12,18-20H,4-5H2,1-3H3,(H,15,16)(H,21,22)/t8-,9+,10+,11+,12+,14+/m0/s1
別名:	methyl 9-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
定義日:	2019-04-08
最終更新日:	2020-07-17
公開日:	2019-06-05
識別子（ID）:	methyl 9-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid

TWY

TWY
表記:	4-thio-beta-D-xylopyranose
組成式:	C5 H10 O4 S
SMILES:	SC1C(C(C(OC1)O)O)O
InChi:	InChI=1S/C5H10O4S/c6-3-2(10)1-9-5(8)4(3)7/h2-8,10H,1H2/t2-,3+,4-,5-/m1/s1
定義日:	2020-04-02
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	4-thio-beta-D-xylopyranose

R2B

R2B
表記:	1,4-anhydro-D-erythro-pent-1-enitol
組成式:	C5 H8 O4
SMILES:	OC1=COC(CO)C1O
InChi:	InChI=1S/C5H8O4/c6-1-4-5(8)3(7)2-9-4/h2,4-8H,1H2/t4-,5+/m1/s1
定義日:	2005-05-11
最終更新日:	2020-07-17
識別子（ID）:	1,4-anhydro-D-erythro-pent-1-enitol

Z15

Z15
表記:	(1S)-1,5-anhydro-1-(4-chloro-2,5-dihydroxyphenyl)-D-glucitol
組成式:	C12 H15 Cl O7
SMILES:	Clc1c(O)cc(c(O)c1)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C12H15ClO7/c13-5-2-6(15)4(1-7(5)16)12-11(19)10(18)9(17)8(3-14)20-12/h1-2,8-12,14-19H,3H2/t8-,9-,10+,11-,12+/m1/s1
定義日:	2010-07-01
最終更新日:	2020-07-17
識別子（ID）:	(1S)-1,5-anhydro-1-(4-chloro-2,5-dihydroxyphenyl)-D-glucitol

Z16

Z16
表記:	(1S)-1,5-anhydro-1-(3-chloro-2,5-dihydroxyphenyl)-D-glucitol
組成式:	C12 H15 Cl O7
SMILES:	Clc1cc(O)cc(c1O)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C12H15ClO7/c13-6-2-4(15)1-5(8(6)16)12-11(19)10(18)9(17)7(3-14)20-12/h1-2,7,9-12,14-19H,3H2/t7-,9-,10+,11-,12+/m1/s1
定義日:	2010-07-01
最終更新日:	2020-07-17
識別子（ID）:	(1S)-1,5-anhydro-1-(3-chloro-2,5-dihydroxyphenyl)-D-glucitol

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

R2G

R2G
表記:	2,5-anhydro-4-deoxy-D-erythro-pent-4-enitol
組成式:	C5 H8 O3
SMILES:	OC[CH]1OC=C[CH]1O
InChi:	InChI=1S/C5H8O3/c6-3-5-4(7)1-2-8-5/h1-2,4-7H,3H2/t4-,5+/m1/s1
定義日:	2009-12-09
最終更新日:	2020-07-17
識別子（ID）:	(2~{S},3~{R})-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol

ADA

ADA
表記:	alpha-D-galactopyranuronic acid
組成式:	C6 H10 O7
SMILES:	O=C(O)C1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2+,3+,4-,6-/m0/s1
別名:	alpha-D-galacturonic acid
定義日:	2002-04-08
最終更新日:	2020-07-17
識別子（ID）:	alpha-D-galactopyranuronic acid

9KJ

9KJ
表記:	{[(2R,3R,4R,5R)-3-(alpha-D-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid
組成式:	C13 H26 N O12 P
SMILES:	C(C2C(OC1C(O)C(C(C(CO)O1)O)O)C(C(N2CP(=O)(O)O)CO)O)O
InChi:	InChI=1S/C13H26NO12P/c15-1-5-8(18)12(6(2-16)14(5)4-27(22,23)24)26-13-11(21)10(20)9(19)7(3-17)25-13/h5-13,15-21H,1-4H2,(H2,22,23,24)/t5-,6-,7-,8-,9-,10+,11-,12-,13-/m1/s1
別名:	{[(2R,3R,4R,5R)-3-(alpha-D-glucosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid
定義日:	2017-05-17
最終更新日:	2020-07-17
公開日:	2017-06-07
識別子（ID）:	{[(2R,3R,4R,5R)-3-(alpha-D-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid

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