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PDB ウェブページステータス検索化合物検索: 43993 件 BIRD

AC5

AC5
表記:	1-AMINOCYCLOPENTANECARBOXYLIC ACID
組成式:	C6 H11 N O2
SMILES:	O=C(O)C1(N)CCCC1
InChi:	InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9)
別名:	CYCLO-LEUCINE
定義日:	2004-11-22
最終更新日:	2023-11-03
識別子（ID）:	1-aminocyclopentanecarboxylic acid

T2X

T2X
表記:	(2R)-2-hydroxy-5-methylhexanoic acid
組成式:	C7 H14 O3
SMILES:	CC(C)CCC(O)C(O)=O
InChi:	InChI=1S/C7H14O3/c1-5(2)3-4-6(8)7(9)10/h5-6,8H,3-4H2,1-2H3,(H,9,10)/t6-/m1/s1
定義日:	2022-07-15
最終更新日:	2023-11-03
公開日:	2023-05-24
識別子（ID）:	(2R)-2-hydroxy-5-methylhexanoic acid

ACA

ACA
表記:	6-AMINOHEXANOIC ACID
組成式:	C6 H13 N O2
SMILES:	O=C(O)CCCCCN
InChi:	InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)
別名:	AMINOCAPROIC ACID
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	6-aminohexanoic acid

ACB

ACB
表記:	3-METHYL-BETA-D-ASPARTIC ACID
組成式:	C5 H9 N O4
SMILES:	O=C(O)C(N)C(C(=O)O)C
InChi:	InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3+/m0/s1
別名:	(3S)-3-methyl-D-aspartic acid
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(3S)-3-methyl-D-aspartic acid

T3
表記:	3,5,3'TRIIODOTHYRONINE
組成式:	C15 H12 I3 N O4
SMILES:	O=C(O)C(N)Cc2cc(I)c(Oc1cc(I)c(O)cc1)c(I)c2
InChi:	InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1
別名:	T3
定義日:	1999-07-12
最終更新日:	2023-11-03
識別子（ID）:	O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-L-tyrosine

ACE

ACE
表記:	ACETYL GROUP
組成式:	C2 H4 O
SMILES:	O=CC
InChi:	InChI=1S/C2H4O/c1-2-3/h2H,1H3
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	acetaldehyde

T3R

T3R
表記:	N,5-dimethyl-L-norleucine
組成式:	C8 H17 N O2
SMILES:	CNC(CCC(C)C)C(=O)O
InChi:	InChI=1S/C8H17NO2/c1-6(2)4-5-7(9-3)8(10)11/h6-7,9H,4-5H2,1-3H3,(H,10,11)/t7-/m0/s1
定義日:	2022-07-15
最終更新日:	2023-11-03
公開日:	2023-05-24
識別子（ID）:	N,5-dimethyl-L-norleucine

T44

T44
表記:	3,5,3',5'-TETRAIODO-L-THYRONINE
組成式:	C15 H11 I4 N O4
SMILES:	O=C(O)C(N)Cc2cc(I)c(Oc1cc(I)c(O)c(I)c1)c(I)c2
InChi:	InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-L-tyrosine

AFC

AFC
表記:	(3R,12R)-3-amino-12-methyltetradecanoic acid
組成式:	C15 H31 N O2
SMILES:	O=C(O)CC(N)CCCCCCCCC(C)CC
InChi:	InChI=1S/C15H31NO2/c1-3-13(2)10-8-6-4-5-7-9-11-14(16)12-15(17)18/h13-14H,3-12,16H2,1-2H3,(H,17,18)/t13-,14-/m1/s1
定義日:	2006-09-27
最終更新日:	2023-11-03
識別子（ID）:	(3R,12R)-3-amino-12-methyltetradecanoic acid

T69

T69
表記:	(2E)-3-{(2R,4S)-2-[(2S,3S,5S,7S)-3,7-dihydroxy-5,8,8-trimethylnonan-2-yl]-1,3-thiazolidin-4-yl}-2-methylprop-2-enoic acid
組成式:	C19 H35 N O4 S
SMILES:	CC(=C/C1NC(SC1)C(C)C(O)CC(C)CC(O)C(C)(C)C)C(=O)O
InChi:	InChI=1S/C19H35NO4S/c1-11(8-16(22)19(4,5)6)7-15(21)13(3)17-20-14(10-25-17)9-12(2)18(23)24/h9,11,13-17,20-22H,7-8,10H2,1-6H3,(H,23,24)/b12-9+/t11-,13-,14-,15-,16-,17+/m0/s1
定義日:	2022-07-18
最終更新日:	2023-11-03
公開日:	2023-05-24
識別子（ID）:	(2E)-3-{(2R,4S)-2-[(2S,3S,5S,7S)-3,7-dihydroxy-5,8,8-trimethylnonan-2-yl]-1,3-thiazolidin-4-yl}-2-methylprop-2-enoic acid

AG2

AG2
表記:	AGMATINE
組成式:	C5 H14 N4
SMILES:	[N@H]=C(N)NCCCCN
InChi:	InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)
別名:	(4-AMINOBUTYL)GUANIDINE
定義日:	2002-10-04
最終更新日:	2023-11-03
識別子（ID）:	1-(4-aminobutyl)guanidine

AGD

AGD
表記:	3-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-D-alanine
組成式:	C8 H10 N6 O3
SMILES:	O=C(O)C(N)Cn1c2N=C(NC(=O)c2nc1)N
InChi:	InChI=1S/C8H10N6O3/c9-3(7(16)17)1-14-2-11-4-5(14)12-8(10)13-6(4)15/h2-3H,1,9H2,(H,16,17)(H3,10,12,13,15)/t3-/m1/s1
定義日:	2008-02-12
最終更新日:	2023-11-03
識別子（ID）:	3-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-D-alanine

T79

T79
表記:	(2S)-2-azanylhex-4-ynoic acid
組成式:	C6 H9 N O2
SMILES:	CC#CC[CH](N)C(O)=O
InChi:	InChI=1S/C6H9NO2/c1-2-3-4-5(7)6(8)9/h5H,4,7H2,1H3,(H,8,9)/t5-/m0/s1
別名:	(S)-2-Aminohex-4-ynoic acid
定義日:	2022-12-21
最終更新日:	2023-11-03
公開日:	2023-03-15
識別子（ID）:	(2~{S})-2-azanylhex-4-ynoic acid

T7C

T7C
表記:	3-({2-[(2-amino-2-oxoethyl)amino]ethyl}sulfanyl)propanoic acid
組成式:	C7 H14 N2 O3 S
SMILES:	O=C(N)CNCCSCCC(=O)O
InChi:	InChI=1S/C7H14N2O3S/c8-6(10)5-9-2-4-13-3-1-7(11)12/h9H,1-5H2,(H2,8,10)(H,11,12)
定義日:	2022-07-19
最終更新日:	2023-11-03
公開日:	2023-05-24
識別子（ID）:	3-({2-[(2-amino-2-oxoethyl)amino]ethyl}sulfanyl)propanoic acid

AGM

AGM
表記:	5-METHYL-ARGININE
組成式:	C7 H17 N4 O2
SMILES:	O=C(O)C(N)CCC(NC(=[NH2+])N)C
InChi:	InChI=1S/C7H16N4O2/c1-4(11-7(9)10)2-3-5(8)6(12)13/h4-5H,2-3,8H2,1H3,(H,12,13)(H4,9,10,11)/p+1/t4-,5-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	amino{[(1S,4S)-4-amino-4-carboxy-1-methylbutyl]amino}methaniminium

AGQ

AGQ
表記:	3-[(3E)-3-(carbamimidoylhydrazono)-4-hydroxy-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine
組成式:	C10 H13 N5 O4
SMILES:	O=C1C=C(O)/C(=N/NC(=[N@H])N)C=C1CC(C(=O)O)N
InChi:	InChI=1S/C10H13N5O4/c11-5(9(18)19)1-4-2-6(14-15-10(12)13)8(17)3-7(4)16/h2-3,5,17H,1,11H2,(H,18,19)(H4,12,13,15)/b14-6+/t5-/m0/s1
定義日:	2010-05-17
最終更新日:	2023-11-03
識別子（ID）:	3-[(3E)-3-(2-carbamimidoylhydrazinylidene)-4-hydroxy-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine

T7H

T7H
表記:	3-({2-[(carboxymethyl)amino]ethyl}sulfanyl)propanoic acid
組成式:	C7 H13 N O4 S
SMILES:	OC(=O)CNCCSCCC(=O)O
InChi:	InChI=1S/C7H13NO4S/c9-6(10)1-3-13-4-2-8-5-7(11)12/h8H,1-5H2,(H,9,10)(H,11,12)
定義日:	2022-07-19
最終更新日:	2023-11-03
公開日:	2023-05-24
識別子（ID）:	3-({2-[(carboxymethyl)amino]ethyl}sulfanyl)propanoic acid

AHB

AHB
表記:	BETA-HYDROXYASPARAGINE
組成式:	C4 H8 N2 O4
SMILES:	O=C(O)C(N)C(O)C(=O)N
InChi:	InChI=1S/C4H8N2O4/c5-1(4(9)10)2(7)3(6)8/h1-2,7H,5H2,(H2,6,8)(H,9,10)/t1-,2-/m0/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(3S)-3-hydroxy-L-asparagine

AHH

AHH
表記:	AMINO-HYDROXYHEPTANOIC ACID
組成式:	C7 H15 N O3
SMILES:	O=C(O)C(O)C(N)CCCC
InChi:	InChI=1S/C7H15NO3/c1-2-3-4-5(8)6(9)7(10)11/h5-6,9H,2-4,8H2,1H3,(H,10,11)/t5-,6+/m1/s1
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	(2S,3R)-3-amino-2-hydroxyheptanoic acid

AHO

AHO
表記:	N-ACETYL-N-HYDROXY-L-ORNITHINE
組成式:	C7 H14 N2 O4
SMILES:	O=C(N(O)CCCC(N)C(=O)O)C
InChi:	InChI=1S/C7H14N2O4/c1-5(10)9(13)4-2-3-6(8)7(11)12/h6,13H,2-4,8H2,1H3,(H,11,12)/t6-/m0/s1
別名:	5-(ACETYL-HYDROXY-AMINO)-2-AMINO-PENTANOIC ACID
定義日:	1999-08-13
最終更新日:	2023-11-03
識別子（ID）:	N~5~-acetyl-N~5~-hydroxy-L-ornithine

AHP

AHP
表記:	2-AMINO-HEPTANOIC ACID
組成式:	C7 H15 N O2
SMILES:	O=C(O)C(N)CCCCC
InChi:	InChI=1S/C7H15NO2/c1-2-3-4-5-6(8)7(9)10/h6H,2-5,8H2,1H3,(H,9,10)/t6-/m0/s1
定義日:	2000-06-15
最終更新日:	2023-11-03
識別子（ID）:	(2S)-2-aminoheptanoic acid

T8L

T8L
表記:	Thio-phosohothreonine
組成式:	C4 H10 N O5 P S
SMILES:	C[CH](O[P](O)(S)=O)[CH](N)C(O)=O
InChi:	InChI=1S/C4H10NO5PS/c1-2(3(5)4(6)7)10-11(8,9)12/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,12)/t2-,3+/m1/s1
定義日:	2017-12-22
最終更新日:	2023-11-03
公開日:	2018-01-03
識別子（ID）:	(2~{S},3~{R})-2-azanyl-3-[oxidanyl(sulfanyl)phosphoryl]oxy-butanoic acid

AIB

AIB
表記:	ALPHA-AMINOISOBUTYRIC ACID
組成式:	C4 H9 N O2
SMILES:	O=C(O)C(N)(C)C
InChi:	InChI=1S/C4H9NO2/c1-4(2,5)3(6)7/h5H2,1-2H3,(H,6,7)
定義日:	1999-07-08
最終更新日:	2023-11-03
識別子（ID）:	2-methyl-L-alanine

T9E

T9E
表記:	Selenothreonine
組成式:	C4 H9 N O2 Se
SMILES:	C[CH]([SeH])[CH](N)C(O)=O
InChi:	InChI=1S/C4H9NO2Se/c1-2(8)3(5)4(6)7/h2-3,8H,5H2,1H3,(H,6,7)/t2-,3+/m1/s1
定義日:	2018-02-17
最終更新日:	2023-11-03
公開日:	2019-02-20
識別子（ID）:	(2~{R},3~{R})-2-azanyl-3-selanyl-butanoic acid

AJE

AJE
表記:	(3S,4R)-4-amino-1-(3-carboxypropanoyl)pyrrolidine-3-carboxylic acid
組成式:	C9 H14 N2 O5
SMILES:	O=C(N1CC(C(=O)O)C(N)C1)CCC(=O)O
InChi:	InChI=1S/C9H14N2O5/c10-6-4-11(3-5(6)9(15)16)7(12)1-2-8(13)14/h5-6H,1-4,10H2,(H,13,14)(H,15,16)/t5-,6-/m0/s1
定義日:	2015-02-04
最終更新日:	2023-11-03
公開日:	2015-09-09
識別子（ID）:	(3S,4R)-4-amino-1-(3-carboxypropanoyl)pyrrolidine-3-carboxylic acid

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