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PDB ウェブページステータス検索化合物検索: 39836 件 BIRD

6KH

6KH
表記:	heptyl 3-fluoro-alpha-D-mannopyranoside
組成式:	C13 H25 F O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](O)[CH](F)[CH]1O
InChi:	InChI=1S/C13H25FO5/c1-2-3-4-5-6-7-18-13-12(17)10(14)11(16)9(8-15)19-13/h9-13,15-17H,2-8H2,1H3/t9-,10+,11-,12+,13+/m1/s1
別名:	3-Fluoro-Heptylmannoside
定義日:	2016-05-27
最終更新日:	2020-07-17
公開日:	2017-06-21
識別子（ID）:	(2~{S},3~{R},4~{S},5~{R},6~{R})-4-fluoranyl-2-heptoxy-6-(hydroxymethyl)oxane-3,5-diol

6KL

6KL
表記:	methyl 4,5-bisacetamido-3,4,5-trideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
組成式:	C14 H24 N2 O9
SMILES:	C(O)(C1(OC)OC(C(C(C1)NC(C)=O)NC(C)=O)C(C(CO)O)O)=O
InChi:	InChI=1S/C14H24N2O9/c1-6(18)15-8-4-14(24-3,13(22)23)25-12(10(8)16-7(2)19)11(21)9(20)5-17/h8-12,17,20-21H,4-5H2,1-3H3,(H,15,18)(H,16,19)(H,22,23)/t8-,9+,10+,11+,12+,14+/m0/s1
別名:	methyl 4,5-bis(acetylamino)-3,4,5-trideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
定義日:	2016-04-22
最終更新日:	2020-07-17
公開日:	2016-05-11
識別子（ID）:	methyl 4,5-bis(acetylamino)-3,4,5-trideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid

6KS

6KS
表記:	heptyl 2-fluoro-alpha-D-mannopyranoside
組成式:	C13 H25 F O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1F
InChi:	InChI=1S/C13H25FO5/c1-2-3-4-5-6-7-18-13-10(14)12(17)11(16)9(8-15)19-13/h9-13,15-17H,2-8H2,1H3/t9-,10+,11-,12-,13+/m1/s1
別名:	2-Fluoro-Heptylmannoside
定義日:	2016-05-27
最終更新日:	2020-07-17
公開日:	2017-06-21
識別子（ID）:	(2~{R},3~{S},4~{S},5~{S},6~{S})-5-fluoranyl-6-heptoxy-2-(hydroxymethyl)oxane-3,4-diol

6KU

6KU
表記:	heptyl 4-deoxy-4-deoxy-alpha-D-mannopyranoside
組成式:	C13 H26 O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)C[CH](O)[CH]1O
InChi:	InChI=1S/C13H26O5/c1-2-3-4-5-6-7-17-13-12(16)11(15)8-10(9-14)18-13/h10-16H,2-9H2,1H3/t10-,11-,12-,13-/m0/s1
別名:	4-Deoxy-Heptylmannoside
定義日:	2016-05-27
最終更新日:	2020-07-17
公開日:	2017-06-21
識別子（ID）:	(2~{S},3~{S},4~{S},6~{S})-2-heptoxy-6-(hydroxymethyl)oxane-3,4-diol

6KW

6KW
表記:	heptyl 3-deoxy-alpha-D-mannopyranoside
組成式:	C13 H26 O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](O)C[CH]1O
InChi:	InChI=1S/C13H26O5/c1-2-3-4-5-6-7-17-13-11(16)8-10(15)12(9-14)18-13/h10-16H,2-9H2,1H3/t10-,11-,12+,13-/m0/s1
別名:	3-Deoxy-Heptylmannoside
定義日:	2016-05-27
最終更新日:	2020-07-17
公開日:	2017-06-21
識別子（ID）:	(2~{S},3~{S},5~{S},6~{R})-2-heptoxy-6-(hydroxymethyl)oxane-3,5-diol

PZU

PZU
表記:	alpha-D-Paratopyranose
組成式:	C6 H12 O4
SMILES:	OC1C(OC(O)C(O)C1)C
InChi:	InChI=1S/C6H12O4/c1-3-4(7)2-5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4+,5-,6+/m1/s1
別名:	alpha-D-Paratose
定義日:	2011-09-02
最終更新日:	2020-07-17
公開日:	2012-08-24
識別子（ID）:	3,6-dideoxy-alpha-D-ribo-hexopyranose

6LW

6LW
表記:	(Z)-L-Arabinonhydroximo-1,4-lactone
組成式:	C5 H9 N O5
SMILES:	OC[CH]1OC(=NO)[CH](O)[CH]1O
InChi:	InChI=1S/C5H9NO5/c7-1-2-3(8)4(9)5(6-10)11-2/h2-4,7-10H,1H2/b6-5-/t2-,3-,4+/m0/s1
別名:	(2~{Z},3~{R},4~{R},5~{S})-2-hydroxyimino-5-(hydroxymethyl)oxolane-3,4-diol
定義日:	2016-05-03
最終更新日:	2020-07-17
公開日:	2016-08-10
識別子（ID）:	(2~{Z},3~{R},4~{R},5~{S})-2-hydroxyimino-5-(hydroxymethyl)oxolane-3,4-diol

6MJ

6MJ
表記:	methyl beta-D-xylopyranoside
組成式:	C6 H12 O5
SMILES:	COC1OCC(C(C1O)O)O
InChi:	InChI=1S/C6H12O5/c1-10-6-5(9)4(8)3(7)2-11-6/h3-9H,2H2,1H3/t3-,4+,5-,6-/m1/s1
別名:	methyl beta-D-xyloside
定義日:	2016-05-09
最終更新日:	2020-07-17
公開日:	2017-05-24
識別子（ID）:	methyl beta-D-xylopyranoside

6MN

6MN
表記:	2-amino-2-deoxy-6-O-phosphono-alpha-D-mannopyranose
組成式:	C6 H14 N O8 P
SMILES:	O=P(O)(O)OCC1OC(O)C(N)C(O)C1O
InChi:	InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3+,4-,5-,6+/m1/s1
別名:	Mannosamine-6-phosphate
定義日:	2009-05-13
最終更新日:	2020-07-17
識別子（ID）:	2-amino-2-deoxy-6-O-phosphono-alpha-D-mannopyranose

Q44

Q44
表記:	N-(6-oxo-6,9-dihydro-3H-purin-2-yl)acetamide
組成式:	C7 H7 N5 O2
SMILES:	C1(N=C(NC(C)=O)Nc2c1ncn2)=O
InChi:	InChI=1S/C7H7N5O2/c1-3(13)10-7-11-5-4(6(14)12-7)8-2-9-5/h2H,1H3,(H3,8,9,10,11,12,13,14)
定義日:	2019-09-19
最終更新日:	2020-07-17
公開日:	2020-07-22
識別子（ID）:	N-(6-oxo-6,9-dihydro-3H-purin-2-yl)acetamide

6PY

6PY
表記:	5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-[(2-methoxyethyl)carbamoyl]-D-glycero-D-galacto-non-2-enon ic acid
組成式:	C16 H27 N5 O9
SMILES:	N(C1C(C(C(OC(NCCOC)=O)C(CO)O)OC(=C1)C(=O)O)NC(C)=O)/C(N)=N
InChi:	InChI=1S/C16H27N5O9/c1-7(23)20-11-8(21-15(17)18)5-10(14(25)26)29-13(11)12(9(24)6-22)30-16(27)19-3-4-28-2/h5,8-9,11-13,22,24H,3-4,6H2,1-2H3,(H,19,27)(H,20,23)(H,25,26)(H4,17,18,21)/t8-,9+,11+,12+,13+/m0/s1
別名:	5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-[(2-methoxyethyl)carbamoyl]-D-glycero-D-galacto-non-2- enonic acid
定義日:	2016-05-19
最終更新日:	2020-07-17
公開日:	2016-06-29
識別子（ID）:	5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-[(2-methoxyethyl)carbamoyl]-D-glycero-D-galacto-non-2- enonic acid

6PZ

6PZ
表記:	5,7-bisacetamido-3,5,7,9-tetradeoxy-L-glycero-alpha-L-manno-non-2-ulopyranosonic acid
組成式:	C13 H22 N2 O8
SMILES:	C[CH](O)[CH](NC(C)=O)[CH]1O[C](O)(C[CH](O)[CH]1NC(C)=O)C(O)=O
InChi:	InChI=1S/C13H22N2O8/c1-5(16)9(14-6(2)17)11-10(15-7(3)18)8(19)4-13(22,23-11)12(20)21/h5,8-11,16,19,22H,4H2,1-3H3,(H,14,17)(H,15,18)(H,20,21)/t5-,8-,9-,10-,11-,13-/m0/s1
別名:	(2~{S},4~{S},5~{S},6~{S})-5-acetamido-6-[(1~{S},2~{S})-1-acetamido-2-oxidanyl-propyl]-2,4-bis(oxidanyl)oxane-2-carboxyl ic acid
定義日:	2016-05-19
最終更新日:	2020-07-17
公開日:	2017-03-08
識別子（ID）:	(2~{S},4~{S},5~{S},6~{S})-5-acetamido-6-[(1~{S},2~{S})-1-acetamido-2-oxidanyl-propyl]-2,4-bis(oxidanyl)oxane-2-carboxyl ic acid

Q6B

Q6B
表記:	[(6~{S},7~{S},9~{Z},12~{R})-12-[(~{Z},2~{S},6~{R},7~{R},9~{R})-4,6-dimethyl-7,9-bis(oxidanyl)dec-4-en-2-yl]-7,9-dimethyl-2-oxidanylidene-1-oxacyclododec-9-en-6-yl] (2~{E},4~{E},6~{E},8~{E},10~{E},12~{S},13~{S},15~{S})-4,6,10-trimethyl-12,13,15-tris(oxidanyl)hexadeca-2,4,6,8,10-pentaenoate
組成式:	C44 H70 O9
SMILES:	C[CH](O)C[CH](O)[CH](C)C=C(C)C[CH](C)[CH]1CC=C(C)C[CH](C)[CH](CCCC(=O)O1)OC(=O)C=CC(C)=CC(C)=CC=CC(C)=C[CH](O)[CH](O)C[CH](C)O
InChi:	InChI=1S/C44H70O9/c1-28(13-11-14-29(2)25-39(48)40(49)27-37(10)46)21-30(3)18-20-44(51)52-41-15-12-16-43(50)53-42(19-17-31(4)22-34(41)7)35(8)24-32(5)23-33(6)38(47)26-36(9)45/h11,13-14,17-18,20-21,23,25,33-42,45-49H,12,15-16,19,22,24,26-27H2,1-10H3/b14-11+,20-18+,28-13+,29-25+,30-21+,31-17-,32-23-/t33-,34+,35+,36-,37+,38-,39+,40+,41+,42-/m1/s1
定義日:	2020-05-22
最終更新日:	2020-07-17
公開日:	2020-07-22
識別子（ID）:	[(6~{S},7~{S},9~{Z},12~{R})-12-[(~{Z},2~{S},6~{R},7~{R},9~{R})-4,6-dimethyl-7,9-bis(oxidanyl)dec-4-en-2-yl]-7,9-dimethyl-2-oxidanylidene-1-oxacyclododec-9-en-6-yl] (2~{E},4~{E},6~{E},8~{E},10~{E},12~{S},13~{S},15~{S})-4,6,10-trimethyl-12,13,15-tris(oxidanyl)hexadeca-2,4,6,8,10-pentaenoate

6S2

6S2
表記:	methyl 2-acetamido-2-deoxy-6-O-sulfo-beta-D-glucopyranoside
組成式:	C9 H17 N O9 S
SMILES:	OC1C(OC(C(C1O)NC(C)=O)OC)COS(O)(=O)=O
InChi:	InChI=1S/C9H17NO9S/c1-4(11)10-6-8(13)7(12)5(19-9(6)17-2)3-18-20(14,15)16/h5-9,12-13H,3H2,1-2H3,(H,10,11)(H,14,15,16)/t5-,6-,7-,8-,9-/m1/s1
別名:	methyl 2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-glucopyranoside
定義日:	2015-03-04
最終更新日:	2020-07-17
公開日:	2016-04-06
識別子（ID）:	methyl 2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-glucopyranoside

9AM

9AM
表記:	9-AMINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID
組成式:	C11 H18 N2 O7
SMILES:	O=C(O)C=1OC(C(O)C(O)CN)C(NC(=O)C)C(O)C=1
InChi:	InChI=1S/C11H18N2O7/c1-4(14)13-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-12/h2,5-6,8-10,15-17H,3,12H2,1H3,(H,13,14)(H,18,19)/t5-,6+,8+,9+,10+/m0/s1
定義日:	2000-07-21
最終更新日:	2020-07-17
識別子（ID）:	5-(acetylamino)-9-amino-2,6-anhydro-3,5,9-trideoxy-D-glycero-D-galacto-non-2-enonic acid

RI2

RI2
表記:	1,5-di-O-phosphono-alpha-D-ribofuranose
組成式:	C5 H12 O11 P2
SMILES:	O=P(O)(O)OCC1OC(OP(=O)(O)O)C(O)C1O
InChi:	InChI=1S/C5H12O11P2/c6-3-2(1-14-17(8,9)10)15-5(4(3)7)16-18(11,12)13/h2-7H,1H2,(H2,8,9,10)(H2,11,12,13)/t2-,3-,4-,5-/m1/s1
別名:	1,5-di-O-phosphono-alpha-D-ribose
定義日:	2011-01-07
最終更新日:	2020-07-17
識別子（ID）:	1,5-di-O-phosphono-alpha-D-ribofuranose

RIB

RIB
表記:	alpha-D-ribofuranose
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:	alpha-D-ribose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	alpha-D-ribofuranose

RIP

RIP
表記:	beta-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:	beta-D-ribose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	beta-D-ribopyranose

9C1

9C1
表記:	2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose
組成式:	C10 H16 Cl N O6
SMILES:	C(=C/CCl)C(=O)NC1C(C(C(CO)OC1O)O)O
InChi:	InChI=1S/C10H16ClNO6/c11-3-1-2-6(14)12-7-9(16)8(15)5(4-13)18-10(7)17/h1-2,5,7-10,13,15-17H,3-4H2,(H,12,14)/b2-1+/t5-,7-,8-,9-,10-/m1/s1
別名:	2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucose
定義日:	2017-04-18
最終更新日:	2020-07-17
公開日:	2017-10-18
識別子（ID）:	2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose

9CD

9CD
表記:	2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose
組成式:	C10 H17 N O6
SMILES:	OC1C(C(OC(C1O)CO)O)NC([C@H]=CC)=O
InChi:	InChI=1S/C10H17NO6/c1-2-3-6(13)11-7-9(15)8(14)5(4-12)17-10(7)16/h2-3,5,7-10,12,14-16H,4H2,1H3,(H,11,13)/b3-2+/t5-,7-,8-,9-,10-/m1/s1
別名:	2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucose
定義日:	2017-04-18
最終更新日:	2020-07-17
公開日:	2017-10-18
識別子（ID）:	2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose

RM4

RM4
表記:	beta-L-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-/m0/s1
別名:	beta-L-rhamnose
定義日:	2008-10-22
最終更新日:	2020-07-17
識別子（ID）:	6-deoxy-beta-L-mannopyranose

9GP

9GP
表記:	N-(hydroxyacetyl)-beta-D-glucopyranosylamine
組成式:	C8 H15 N O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)CO
InChi:	InChI=1S/C8H15NO7/c10-1-3-5(13)6(14)7(15)8(16-3)9-4(12)2-11/h3,5-8,10-11,13-15H,1-2H2,(H,9,12)/t3-,5-,6+,7-,8-/m1/s1
別名:	N-(hydroxyacetyl)-beta-D-glucosylamine
定義日:	2009-02-05
最終更新日:	2020-07-17
識別子（ID）:	N-(hydroxyacetyl)-beta-D-glucopyranosylamine

RP3

RP3
表記:	3-deoxy-5-O-phosphono-beta-D-ribofuranose
組成式:	C5 H11 O7 P
SMILES:	OP(O)(=O)OCC1OC(C(C1)O)O
InChi:	InChI=1S/C5H11O7P/c6-4-1-3(12-5(4)7)2-11-13(8,9)10/h3-7H,1-2H2,(H2,8,9,10)/t3-,4+,5+/m0/s1
別名:	3'-deoxy-D-ribofuranose-5'-phosphate
定義日:	2015-07-28
最終更新日:	2020-07-17
公開日:	2015-10-21
識別子（ID）:	3-deoxy-5-O-phosphono-beta-D-erythro-pentofuranose

RP5

RP5
表記:	5-O-phosphono-beta-D-ribofuranose
組成式:	C5 H11 O8 P
SMILES:	O=P(O)(O)OCC1OC(O)C(O)C1O
InChi:	InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1
別名:	[(2R,3S,4S,5R)-3,4,5-TRIHYDROXYTETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN PHOSPHATE
定義日:	2003-04-30
最終更新日:	2020-07-17
識別子（ID）:	5-O-phosphono-beta-D-ribofuranose

RP6

RP6
表記:	5-acetamido-2,6-anhydro-3,5-dideoxy-3-prop-2-en-1-yl-D-glycero-D-galacto-non-2-enonic acid
組成式:	C14 H21 N O8
SMILES:	O=C(O)C=1OC(C(O)C(O)CO)C(NC(=O)C)C(O)C=1C/C=C
InChi:	InChI=1S/C14H21NO8/c1-3-4-7-10(19)9(15-6(2)17)13(11(20)8(18)5-16)23-12(7)14(21)22/h3,8-11,13,16,18-20H,1,4-5H2,2H3,(H,15,17)(H,21,22)/t8-,9-,10+,11-,13-/m1/s1
別名:	5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-prop-2-en-1-yl-D-glycero-D-galacto-non-2-enonic acid
定義日:	2010-10-27
最終更新日:	2020-07-17
識別子（ID）:	5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-prop-2-en-1-yl-D-glycero-D-galacto-non-2-enonic acid

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