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: 35418 件 BIRD

HIX

HIX
表記:	3-(1H-1,2,3-triazol-5-yl)-L-alanine
組成式:	C5 H8 N4 O2
SMILES:	NC(C(O)=O)Cc1nnnc1
InChi:	InChI=1S/C5H8N4O2/c6-4(5(10)11)1-3-2-7-9-8-3/h2,4H,1,6H2,(H,10,11)(H,7,8,9)/t4-/m0/s1
定義日:	2015-05-26
最終更新日:	2023-11-03
公開日:	2016-02-03
識別子（ID）:	3-(1H-1,2,3-triazol-5-yl)-L-alanine

ZS8

ZS8
表記:	(2S)-2-amino-2-methyldec-8-ynoic acid
組成式:	C11 H19 N O2
SMILES:	NC(C(=O)O)(C)CCCCCC#CC
InChi:	InChI=1S/C11H19NO2/c1-3-4-5-6-7-8-9-11(2,12)10(13)14/h5-9,12H2,1-2H3,(H,13,14)/t11-/m0/s1
定義日:	2016-04-06
最終更新日:	2023-11-03
公開日:	2016-10-19
識別子（ID）:	(2S)-2-amino-2-methyldec-8-ynoic acid

YOF

YOF
表記:	3-FLUOROTYROSINE
組成式:	C9 H10 F N O3
SMILES:	Fc1cc(ccc1O)CC(C(=O)O)N
InChi:	InChI=1S/C9H10FNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	3-fluoro-L-tyrosine

ZSN

ZSN
表記:	1-(2-amino-2-oxoethyl)hydrazinecarboxylic acid
組成式:	C3 H7 N3 O3
SMILES:	O=C(N)CN(N)C(=O)O
InChi:	InChI=1S/C3H7N3O3/c4-2(7)1-6(5)3(8)9/h1,5H2,(H2,4,7)(H,8,9)
別名:	Aza-asparagine
定義日:	2012-06-01
最終更新日:	2023-11-03
公開日:	2013-06-26
識別子（ID）:	1-(2-amino-2-oxoethyl)hydrazinecarboxylic acid

V1V

V1V
表記:	(2S,3S)-3-amino-2-hydroxyhexanoic acid
組成式:	C6 H13 N O3
SMILES:	CCCC(N)C(O)C(O)=O
InChi:	InChI=1S/C6H13NO3/c1-2-3-4(7)5(8)6(9)10/h4-5,8H,2-3,7H2,1H3,(H,9,10)/t4-,5-/m0/s1
定義日:	2020-06-16
最終更新日:	2023-11-03
公開日:	2020-06-24
識別子（ID）:	(2S,3S)-3-amino-2-hydroxyhexanoic acid

ZT1

ZT1
表記:	N~6~-[(1-methyl-1H-imidazol-5-yl)methyl]-N~6~-propan-2-yl-L-lysine
組成式:	C14 H26 N4 O2
SMILES:	Cn1cncc1CN(CCCCC(N)C(=O)O)C(C)C
InChi:	InChI=1S/C14H26N4O2/c1-11(2)18(9-12-8-16-10-17(12)3)7-5-4-6-13(15)14(19)20/h8,10-11,13H,4-7,9,15H2,1-3H3,(H,19,20)/t13-/m0/s1
定義日:	2021-05-28
最終更新日:	2023-11-03
公開日:	2021-07-21
識別子（ID）:	N~6~-[(1-methyl-1H-imidazol-5-yl)methyl]-N~6~-propan-2-yl-L-lysine

ZAL

ZAL
表記:	3-cyclohexyl-D-alanine
組成式:	C9 H17 N O2
SMILES:	O=C(O)C(N)CC1CCCCC1
InChi:	InChI=1S/C9H17NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h7-8H,1-6,10H2,(H,11,12)/t8-/m1/s1
定義日:	2009-01-26
最終更新日:	2023-11-03
識別子（ID）:	3-cyclohexyl-D-alanine

ZT6

ZT6
表記:	(betaR)-3-chloro-beta-{[tri(propan-2-yl)silyl]oxy}-L-tyrosine
組成式:	C18 H30 Cl N O4 Si
SMILES:	Oc1ccc(cc1Cl)C(O[Si](C(C)C)(C(C)C)C(C)C)C(N)C(=O)O
InChi:	InChI=1S/C18H30ClNO4Si/c1-10(2)25(11(3)4,12(5)6)24-17(16(20)18(22)23)13-7-8-15(21)14(19)9-13/h7-12,16-17,21H,20H2,1-6H3,(H,22,23)/t16-,17+/m0/s1
定義日:	2023-03-30
最終更新日:	2023-11-03
公開日:	2023-06-21
識別子（ID）:	(betaR)-3-chloro-beta-{[tri(propan-2-yl)silyl]oxy}-L-tyrosine

ZTG

ZTG
表記:	(betaR)-3-chloro-beta-{[tri(propan-2-yl)silyl]oxy}-D-tyrosine
組成式:	C18 H30 Cl N O4 Si
SMILES:	Oc1ccc(cc1Cl)C(O[Si](C(C)C)(C(C)C)C(C)C)C(N)C(=O)O
InChi:	InChI=1S/C18H30ClNO4Si/c1-10(2)25(11(3)4,12(5)6)24-17(16(20)18(22)23)13-7-8-15(21)14(19)9-13/h7-12,16-17,21H,20H2,1-6H3,(H,22,23)/t16-,17-/m1/s1
定義日:	2023-03-30
最終更新日:	2023-11-03
公開日:	2023-06-21
識別子（ID）:	(betaR)-3-chloro-beta-{[tri(propan-2-yl)silyl]oxy}-D-tyrosine

ZTK

ZTK
表記:	(2S)-2-amino-3-cyanopropanoic acid
組成式:	C4 H6 N2 O2
SMILES:	N#CCC(N)C(=O)O
InChi:	InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)/t3-/m0/s1
定義日:	2023-03-30
最終更新日:	2023-11-03
公開日:	2023-06-21
識別子（ID）:	(2S)-2-amino-3-cyanopropanoic acid

YPZ

YPZ
表記:	3-[(3Z)-4-hydroxy-6-oxo-3-(2-phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]-L-alanine
組成式:	C15 H15 N3 O4
SMILES:	O=C2C=C(O)C(=N/Nc1ccccc1)C=C2CC(C(=O)O)N
InChi:	InChI=1S/C15H15N3O4/c16-11(15(21)22)6-9-7-12(14(20)8-13(9)19)18-17-10-4-2-1-3-5-10/h1-5,7-8,11,17,20H,6,16H2,(H,21,22)/b18-12-/t11-/m0/s1
定義日:	2013-04-12
最終更新日:	2023-11-03
公開日:	2013-04-24
識別子（ID）:	3-[(3Z)-4-hydroxy-6-oxo-3-(2-phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]-L-alanine

ZTT

ZTT
表記:	(1R)-7-[2-[[(1R)-1,3-dimethyl-2-oxidanylidene-1H-3-benzazepin-7-yl]oxy]ethoxy]-1,3-dimethyl-1H-3-benzazepin-2-one
組成式:	C26 H28 N2 O4
SMILES:	C[CH]1C(=O)N(C)C=Cc2cc(OCCOc3ccc4[CH](C)C(=O)N(C)C=Cc4c3)ccc12
InChi:	InChI=1S/C26H28N2O4/c1-17-23-7-5-21(15-19(23)9-11-27(3)25(17)29)31-13-14-32-22-6-8-24-18(2)26(30)28(4)12-10-20(24)16-22/h5-12,15-18H,13-14H2,1-4H3
別名:	(1R,1'R)-7,7'-(ethane-1,2-diylbis(oxy))bis(1,3-dimethyl-1,3-dihydro-2H-benzo[d]azepin-2-one)
定義日:	2023-07-25
最終更新日:	2023-11-03
公開日:	2023-11-08
識別子（ID）:	(1~{R})-7-[2-[[(1~{R})-1,3-dimethyl-2-oxidanylidene-1~{H}-3-benzazepin-7-yl]oxy]ethoxy]-1,3-dimethyl-1~{H}-3-benzazepin-2-one

ZU0

ZU0
表記:	O-tert-butyl-L-threonine
組成式:	C8 H17 N O3
SMILES:	O=C(O)C(N)C(OC(C)(C)C)C
InChi:	InChI=1S/C8H17NO3/c1-5(6(9)7(10)11)12-8(2,3)4/h5-6H,9H2,1-4H3,(H,10,11)/t5-,6+/m1/s1
定義日:	2008-12-10
最終更新日:	2023-11-03
識別子（ID）:	O-tert-butyl-L-threonine

ZBZ

ZBZ
表記:	S-(phenylcarbonyl)-L-cysteine
組成式:	C10 H11 N O3 S
SMILES:	O=C(O)C(N)CSC(=O)c1ccccc1
InChi:	InChI=1S/C10H11NO3S/c11-8(9(12)13)6-15-10(14)7-4-2-1-3-5-7/h1-5,8H,6,11H2,(H,12,13)/t8-/m0/s1
定義日:	2010-02-09
最終更新日:	2023-11-03
識別子（ID）:	S-benzoyl-L-cysteine

ZCL

ZCL
表記:	3,4-dichloro-L-phenylalanine
組成式:	C9 H9 Cl2 N O2
SMILES:	Clc1ccc(cc1Cl)CC(C(=O)O)N
InChi:	InChI=1S/C9H9Cl2NO2/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-3,8H,4,12H2,(H,13,14)/t8-/m0/s1
定義日:	2010-12-29
最終更新日:	2023-11-03
識別子（ID）:	3,4-dichloro-L-phenylalanine

YAC

YAC
表記:	(4Z)-6-oxo-6-phenylhex-4-enoic acid
組成式:	C12 H12 O3
SMILES:	O=C(C=C/CCC(=O)O)c1ccccc1
InChi:	InChI=1S/C12H12O3/c13-11(8-4-5-9-12(14)15)10-6-2-1-3-7-10/h1-4,6-8H,5,9H2,(H,14,15)/b8-4-
定義日:	2014-10-02
最終更新日:	2023-11-03
公開日:	2014-12-03
識別子（ID）:	(4Z)-6-oxo-6-phenylhex-4-enoic acid

HL5

HL5
表記:	(2S,4R)-5-hydroxyleucine
組成式:	C6 H13 N O3
SMILES:	C[CH](CO)C[CH](N)C(O)=O
InChi:	InChI=1S/C6H13NO3/c1-4(3-8)2-5(7)6(9)10/h4-5,8H,2-3,7H2,1H3,(H,9,10)/t4-,5+/m1/s1
定義日:	2017-03-07
最終更新日:	2023-11-03
公開日:	2017-10-04
識別子（ID）:	(2~{S},4~{R})-2-azanyl-4-methyl-5-oxidanyl-pentanoic acid

ZV4

ZV4
表記:	(2S)-2-azanyl-3-(4-phosphonophenyl)propanoic acid
組成式:	C9 H12 N O5 P
SMILES:	N[CH](Cc1ccc(cc1)[P](O)(O)=O)C(O)=O
InChi:	InChI=1S/C9H12NO5P/c10-8(9(11)12)5-6-1-3-7(4-2-6)16(13,14)15/h1-4,8H,5,10H2,(H,11,12)(H2,13,14,15)/t8-/m0/s1
別名:	phosphophenylalanine
定義日:	2023-04-06
最終更新日:	2023-11-03
公開日:	2023-04-19
識別子（ID）:	(2~{S})-2-azanyl-3-(4-phosphonophenyl)propanoic acid

ZDJ

ZDJ
表記:	3-methyl-L-tyrosine
組成式:	C10 H13 N O3
SMILES:	Cc1cc(CC(N)C(=O)O)ccc1O
InChi:	InChI=1S/C10H13NO3/c1-6-4-7(2-3-9(6)12)5-8(11)10(13)14/h2-4,8,12H,5,11H2,1H3,(H,13,14)/t8-/m0/s1
定義日:	2021-04-15
最終更新日:	2023-11-03
公開日:	2021-12-29
識別子（ID）:	3-methyl-L-tyrosine

HLX

HLX
表記:	5-methyl-L-norleucine
組成式:	C7 H15 N O2
SMILES:	O=C(O)C(N)CCC(C)C
InChi:	InChI=1S/C7H15NO2/c1-5(2)3-4-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t6-/m0/s1
定義日:	2013-03-28
最終更新日:	2023-11-03
公開日:	2013-06-12
識別子（ID）:	5-methyl-L-norleucine

V4F

V4F
表記:	8-(aminomethyl)-4-(phosphonomethoxy)quinoline-2-carboxylic acid
組成式:	C12 H13 N2 O6 P
SMILES:	NCc1cccc2c(OC[P](O)(O)=O)cc(nc12)C(O)=O
InChi:	InChI=1S/C12H13N2O6P/c13-5-7-2-1-3-8-10(20-6-21(17,18)19)4-9(12(15)16)14-11(7)8/h1-4H,5-6,13H2,(H,15,16)(H2,17,18,19)
定義日:	2023-02-21
最終更新日:	2023-11-03
公開日:	2023-07-19
識別子（ID）:	8-(aminomethyl)-4-(phosphonomethoxy)quinoline-2-carboxylic acid

HM9

HM9
表記:	6-(3-CARBAMIMIDAMIDOPROPYL)-3,5-DIHYDROXYPYRAZINE-2-CARBOTHIOIC S-ACID
組成式:	C9 H13 N5 O3 S
SMILES:	O=C(S)c1nc(c(O)nc1O)CCCNC(=[N@H])N
InChi:	InChI=1S/C9H13N5O3S/c10-9(11)12-3-1-2-4-6(15)14-7(16)5(13-4)8(17)18/h1-3H2,(H,17,18)(H4,10,11,12)(H2,14,15,16)
定義日:	2011-04-18
最終更新日:	2023-11-03
識別子（ID）:	6-(3-carbamimidamidopropyl)-3,5-dihydroxypyrazine-2-carbothioic S-acid

HMF

HMF
表記:	2-AMINO-4-PHENYL-BUTYRIC ACID
組成式:	C10 H13 N O2
SMILES:	O=C(O)C(N)CCc1ccccc1
InChi:	InChI=1S/C10H13NO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m1/s1
別名:	D-BETA-HOMOPHENYLALANINE
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(2R)-2-amino-4-phenylbutanoic acid

V53

V53
表記:	8-azanyl-4-(phosphonomethoxy)quinoline-2-carboxylic acid
組成式:	C11 H11 N2 O6 P
SMILES:	Nc1cccc2c(OC[P](O)(O)=O)cc(nc12)C(O)=O
InChi:	InChI=1S/C11H11N2O6P/c12-7-3-1-2-6-9(19-5-20(16,17)18)4-8(11(14)15)13-10(6)7/h1-4H,5,12H2,(H,14,15)(H2,16,17,18)
定義日:	2023-02-21
最終更新日:	2023-11-03
公開日:	2023-07-19
識別子（ID）:	8-azanyl-4-(phosphonomethoxy)quinoline-2-carboxylic acid

V5F

V5F
表記:	(2R)-2-(2-azanylphenoxy)propanoic acid
組成式:	C9 H11 N O3
SMILES:	C[CH](Oc1ccccc1N)C(O)=O
InChi:	InChI=1S/C9H11NO3/c1-6(9(11)12)13-8-5-3-2-4-7(8)10/h2-6H,10H2,1H3,(H,11,12)/t6-/m1/s1
定義日:	2023-02-21
最終更新日:	2023-11-03
公開日:	2023-07-19
識別子（ID）:	(2~{R})-2-(2-azanylphenoxy)propanoic acid

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