Chemie クエリの検索結果 - 日本蛋白質構造データバンク

English 日本語简体中文繁體中文 한국어

✖

ﾒﾆｭｰ

RCSB PDB PDBe BMRB Adv. Search Search help

PDB ウェブページステータス検索化合物検索: 39822 件 BIRD

05W

05W
表記:	(2R,3S,4S)-4-azanyl-2,6-dimethyl-heptane-1,3-diol
組成式:	C9 H21 N O2
SMILES:	CC(C)C[CH](N)[CH](O)[CH](C)CO
InChi:	InChI=1S/C9H21NO2/c1-6(2)4-8(10)9(12)7(3)5-11/h6-9,11-12H,4-5,10H2,1-3H3/t7-,8+,9+/m1/s1
定義日:	2012-12-10
最終更新日:	2023-11-03
公開日:	2014-02-12
識別子（ID）:	(2R,3S,4S)-4-azanyl-2,6-dimethyl-heptane-1,3-diol

060

060
表記:	S-methyl-D-cysteine
組成式:	C4 H9 N O2 S
SMILES:	O=C(O)C(N)CSC
InChi:	InChI=1S/C4H9NO2S/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1
定義日:	2013-01-25
最終更新日:	2023-11-03
公開日:	2013-03-20
識別子（ID）:	S-methyl-D-cysteine

APD

APD
表記:	3-METHYLPHENYLALANINE
組成式:	C10 H13 N O2
SMILES:	O=C(O)C(N)Cc1cccc(c1)C
InChi:	InChI=1S/C10H13NO2/c1-7-3-2-4-8(5-7)6-9(11)10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m0/s1
定義日:	2001-09-28
最終更新日:	2023-11-03
識別子（ID）:	3-methyl-L-phenylalanine

06E

06E
表記:	6-[(11-bromanyl-6-oxidanylidene-8-thia-3,5,13-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,10,12-pentaen-4-yl)methylamino]hexanoic acid
組成式:	C16 H17 Br N4 O3 S
SMILES:	OC(=O)CCCCCNCC1=Nc2c(sc3cc(Br)cnc23)C(=O)N1
InChi:	InChI=1S/C16H17BrN4O3S/c17-9-6-10-13(19-7-9)14-15(25-10)16(24)21-11(20-14)8-18-5-3-1-2-4-12(22)23/h6-7,18H,1-5,8H2,(H,22,23)(H,20,21,24)
定義日:	2021-05-28
最終更新日:	2023-11-03
公開日:	2021-08-04
識別子（ID）:	6-[(11-bromanyl-6-oxidanylidene-8-thia-3,5,13-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,10,12-pentaen-4-yl)methylamino]hexanoic acid

API

API
表記:	2,6-DIAMINOPIMELIC ACID
組成式:	C7 H14 N2 O4
SMILES:	O=C(O)C(N)CCCC(C(=O)O)N
InChi:	InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5+
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(2R,6S)-2,6-diaminoheptanedioic acid

APN

APN
表記:	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE
組成式:	C11 H16 N7 O3
SMILES:	O=C(O)CN(C(=O)Cn1c2ncnc(c2nc1)N)CC[NH3+]
InChi:	InChI=1S/C11H15N7O3/c12-1-2-17(4-8(20)21)7(19)3-18-6-16-9-10(13)14-5-15-11(9)18/h5-6H,1-4,12H2,(H,20,21)(H2,13,14,15)/p+1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	2-{[(6-amino-9H-purin-9-yl)acetyl](carboxymethyl)amino}ethanaminium

AR0

AR0
表記:	4-amino-1-{[amino(iminio)methyl]amino}-6-[4-(carboxymethyl)pyridinium-1-yl]-1,2,3,4,6-pentadeoxy-D-erythro-hexitol
組成式:	C14 H25 N5 O3
SMILES:	O=C(O)Cc1cc[n+](cc1)CC(O)C(N)CCCNC(=[NH2+])N
InChi:	InChI=1S/C14H23N5O3/c15-11(2-1-5-18-14(16)17)12(20)9-19-6-3-10(4-7-19)8-13(21)22/h3-4,6-7,11-12,20H,1-2,5,8-9,15H2,(H4-,16,17,18,21,22)/p+2/t11-,12+/m0/s1
定義日:	2010-09-17
最終更新日:	2023-11-03
識別子（ID）:	4-amino-1-{[amino(iminio)methyl]amino}-6-[4-(carboxymethyl)pyridinium-1-yl]-1,2,3,4,6-pentadeoxy-D-erythro-hexitol

AR7

AR7
表記:	amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium
組成式:	C6 H17 N4 O2
SMILES:	OC(O)C(N)CCCNC(=[NH2+])N
InChi:	InChI=1S/C6H16N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4-5,11-12H,1-3,7H2,(H4,8,9,10)/p+1/t4-/m0/s1
定義日:	2010-09-24
最終更新日:	2023-11-03
識別子（ID）:	amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium

ARG

ARG
表記:	ARGININE
組成式:	C6 H15 N4 O2
SMILES:	O=C(O)C(N)CCCNC(=[NH2+])N
InChi:	InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/p+1/t4-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	amino{[(4S)-4-amino-4-carboxybutyl]amino}methaniminium

08M

08M
表記:	N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine
組成式:	C10 H14 N4 O3
SMILES:	O=C(NCCCC(C(=O)O)N)c1nccnc1
InChi:	InChI=1S/C10H14N4O3/c11-7(10(16)17)2-1-3-14-9(15)8-6-12-4-5-13-8/h4-7H,1-3,11H2,(H,14,15)(H,16,17)/t7-/m0/s1
定義日:	2011-10-13
最終更新日:	2023-11-03
識別子（ID）:	N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine

ARM

ARM
表記:	DEOXY-METHYL-ARGININE
組成式:	C7 H16 N4 O
SMILES:	O=C(C)C(N)CCCNC(=[N@H])N
InChi:	InChI=1S/C7H16N4O/c1-5(12)6(8)3-2-4-11-7(9)10/h6H,2-4,8H2,1H3,(H4,9,10,11)/t6-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	1-[(4S)-4-amino-5-oxohexyl]guanidine

ARO

ARO
表記:	C-GAMMA-HYDROXY ARGININE
組成式:	C6 H15 N4 O3
SMILES:	O=C(O)C(N)CC(O)CNC(N)=[NH2+]
InChi:	InChI=1S/C6H14N4O3/c7-4(5(12)13)1-3(11)2-10-6(8)9/h3-4,11H,1-2,7H2,(H,12,13)(H4,8,9,10)/p+1/t3-,4+/m1/s1
定義日:	2000-09-05
最終更新日:	2023-11-03
識別子（ID）:	amino{[(2R,4S)-4-amino-2,5-dihydroxy-5-oxopentyl]amino}methaniminium

ASA

ASA
表記:	ASPARTIC ALDEHYDE
組成式:	C4 H7 N O3
SMILES:	O=CC(N)CC(=O)O
InChi:	InChI=1S/C4H7NO3/c5-3(2-6)1-4(7)8/h2-3H,1,5H2,(H,7,8)/t3-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(3S)-3-amino-4-oxobutanoic acid

ASB

ASB
表記:	ASPARTIC ACID-4-CARBOXYMETHYL ESTER
組成式:	C6 H9 N O6
SMILES:	O=C(OCC(=O)O)CC(C(=O)O)N
InChi:	InChI=1S/C6H9NO6/c7-3(6(11)12)1-5(10)13-2-4(8)9/h3H,1-2,7H2,(H,8,9)(H,11,12)/t3-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(2S)-2-amino-4-(carboxymethoxy)-4-oxobutanoic acid (non-preferred name)

ASJ

ASJ
表記:	(3S)-3-amino-4-hydroxybutanoic acid
組成式:	C4 H9 N O3
SMILES:	O=C(O)CC(N)CO
InChi:	InChI=1S/C4H9NO3/c5-3(2-6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1
定義日:	2010-10-07
最終更新日:	2023-11-03
識別子（ID）:	(3S)-3-amino-4-hydroxybutanoic acid

ASL

ASL
表記:	ASPARTIC ACID-4-CARBOXYETHYL ESTER
組成式:	C7 H11 N O6
SMILES:	O=C(OC(C(=O)O)C)CC(C(=O)O)N
InChi:	InChI=1S/C7H11NO6/c1-3(6(10)11)14-5(9)2-4(8)7(12)13/h3-4H,2,8H2,1H3,(H,10,11)(H,12,13)
定義日:	1999-09-09
最終更新日:	2023-11-03
識別子（ID）:	2-amino-4-(1-carboxyethoxy)-4-oxobutanoic acid (non-preferred name)

ASN

ASN
表記:	ASPARAGINE
組成式:	C4 H8 N2 O3
SMILES:	O=C(N)CC(N)C(=O)O
InChi:	InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	L-asparagine

ASP

ASP
表記:	ASPARTIC ACID
組成式:	C4 H7 N O4
SMILES:	O=C(O)CC(N)C(=O)O
InChi:	InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	L-aspartic acid

ASX

ASX
表記:	ASP/ASN AMBIGUOUS
組成式:	C4 H6 N O2 X2
SMILES:	C(C[CH](N)C(O)=O)(=[F,Cl,Br,I])[F,Cl,Br,I]
定義日:	1999-07-08
最終更新日:	2023-11-03

0A0

0A0
表記:	2-methyl-L-aspartic acid
組成式:	C5 H9 N O4
SMILES:	O=C(O)CC(N)(C(=O)O)C
InChi:	InChI=1S/C5H9NO4/c1-5(6,4(9)10)2-3(7)8/h2,6H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1
定義日:	2007-11-09
最終更新日:	2023-11-03
識別子（ID）:	2-methyl-L-aspartic acid

0A1

0A1
表記:	O-methyl-L-tyrosine
組成式:	C10 H13 N O3
SMILES:	O=C(O)C(N)Cc1ccc(OC)cc1
InChi:	InChI=1S/C10H13NO3/c1-14-8-4-2-7(3-5-8)6-9(11)10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m0/s1
定義日:	2007-11-09
最終更新日:	2023-11-03
識別子（ID）:	O-methyl-L-tyrosine

0A9

0A9
表記:	methyl L-phenylalaninate
組成式:	C10 H13 N O2
SMILES:	O=C(OC)C(N)Cc1ccccc1
InChi:	InChI=1S/C10H13NO2/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9H,7,11H2,1H3/t9-/m0/s1
定義日:	2007-11-09
最終更新日:	2023-11-03
識別子（ID）:	methyl L-phenylalaninate

0AF

0AF
表記:	7-hydroxy-L-tryptophan
組成式:	C11 H12 N2 O3
SMILES:	O=C(O)C(N)Cc2c1cccc(O)c1nc2
InChi:	InChI=1S/C11H12N2O3/c12-8(11(15)16)4-6-5-13-10-7(6)2-1-3-9(10)14/h1-3,5,8,13-14H,4,12H2,(H,15,16)/t8-/m0/s1
定義日:	2007-11-11
最終更新日:	2023-11-03
識別子（ID）:	7-hydroxy-L-tryptophan

0AK

0AK
表記:	(2S)-2-amino-4-(2-chloroethoxy)-4-oxobutanoic acid
組成式:	C6 H10 Cl N O4
SMILES:	O=C(OCCCl)CC(N)C(=O)O
InChi:	InChI=1S/C6H10ClNO4/c7-1-2-12-5(9)3-4(8)6(10)11/h4H,1-3,8H2,(H,10,11)/t4-/m0/s1
定義日:	2007-11-11
最終更新日:	2023-11-03
識別子（ID）:	(2S)-2-amino-4-(2-chloroethoxy)-4-oxobutanoic acid (non-preferred name)

0AR

0AR
表記:	N-[N-[(4S)-4-azanyl-5-hydroxy-5-oxo-pentyl]carbamimidoyl]ethanamide
組成式:	C8 H16 N4 O3
SMILES:	O=C(O)C(N)CCCNC(=[N@H])NC(=O)C
InChi:	InChI=1S/C8H16N4O3/c1-5(13)12-8(10)11-4-2-3-6(9)7(14)15/h6H,2-4,9H2,1H3,(H,14,15)(H3,10,11,12,13)/t6-/m0/s1
定義日:	2009-07-10
最終更新日:	2023-11-03
識別子（ID）:	N~5~-(N-acetylcarbamimidoyl)-L-ornithine

<116 117 118 119 120 121 122123124 125 126 127 128 129 130 131 >

222415

件を2024-07-10に公開中

PDB statistics

PDBj update info

Contact PDBj

numon