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PDB ウェブページステータス検索化合物検索: 44216 件 BIRD

A72

A72
表記:	TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEX
組成式:	C12 H36 N4 Pt
SMILES:	N.N.[Pt].CCCCCCN.CCCCCCN
InChi:	InChI=1S/2C6H15N.2H3N.Pt/c2*1-2-3-4-5-6-7
定義日:	2006-10-10
最終更新日:	2023-09-23
識別子（ID）:	bis(hexyl-$l^{4}-azanyl)-bis($l^{4}-azanyl)platinum

CBY

CBY
表記:	COB(II)INAMIDE
組成式:	C48 H72 Co N11 O8
SMILES:	[Co++].C[CH](O)CNC(=O)CC[C]1(C)[CH](CC(N)=O)[CH]2[N-]C1=C(C)C3=NC(=CC4=NC(=C(C)C5=N[C]2(C)[C](C)(CC(N)=O)[CH]5CCC(N)=O)[C](C)(CC(N)=O)[CH]4CCC(N)=O)C(C)(C)[CH]3CCC(N)=O
InChi:	InChI=1S/C48H73N11O8.Co/c1-23(60)22-55-38(67)16-17-45(6)29(18-35(52)64)43-48(9)47(8,21-37(54)66)28(12-15-34(51)63)40(59-48)25(3)42-46(7,20-36(53)65)26(10-13-32(49)61)30(56-42)19-31-44(4,5)27(11-14-33(50)62)39(57-31)24(2)41(45)58-43
定義日:	2008-03-27
最終更新日:	2023-09-23

CCH

CCH
表記:	[7-ETHENYL-12-FORMYL-3,8,13,17-TERTRAMETHYL-21H,23H-PORPHINE-2,18-DIPROPANOATO(2)-N21,N22,N23,N24]IRON
組成式:	C33 H30 Fe N4 O5
SMILES:	CC1=C(CCC(O)=O)C2=NC1=Cc3n4[Fe][N]5C(=CC6=NC(=Cc4c(C)c3C=C)C(=C6C)C=O)C(=C(CCC(O)=O)C5=C2)C
InChi:	InChI=1S/C33H32N4O5.Fe/c1-6-20-16(2)26-13-31-23(15-38)19(5)25(37-31)11-24-17(3)21(7-9-32(39)40)29(35-24)14-30-22(8-10-33(41)42)18(4)27(36-30)12-28(20)34-26
別名:	CLOROCRUORO HEM
定義日:	1999-07-08
最終更新日:	2023-09-23

CFM

CFM
表記:	FE-MO-S CLUSTER
組成式:	Fe7 Mo S9
SMILES:	S1[Fe]S[Fe]S[Mo]2S[Fe]S[Fe]S[Fe](S[Fe]1)S[Fe]S2
InChi:	InChI=1S/7Fe.Mo.9S
定義日:	1999-07-08
最終更新日:	2023-09-23

CLF

CLF
表記:	FE(8)-S(7) CLUSTER
組成式:	Fe8 S7
SMILES:	S1[Fe]S[Fe]2S[Fe][S]234([Fe]1)[Fe]S[Fe]S[Fe]3S[Fe]4
InChi:	InChI=1S/8Fe.7S
定義日:	1999-07-08
最終更新日:	2023-09-23

B17

B17
表記:	{1-[4-(AMINOSULFONYL)PHENYL]-11-[(CARBOXY-KAPPAO)METHYL]-1-OXO-5,8-DIOXA-2,11-DIAZATRIDECAN-13-OATO(2-)-KAPPAO~13~}COPPER
組成式:	C17 H23 Cu N3 O9 S
SMILES:	O=C1O[Cu]OC(=O)CN(C1)CCOCCOCCNC(=O)c2ccc(cc2)S(=O)(=O)N
InChi:	InChI=1S/C17H25N3O9S.Cu/c18-30(26,27)14-3-1-13(2-4-14)17(25)19-5-7-28-9-10-29-8-6-20(11-15(21)22)12-16(23)24
定義日:	2006-03-27
最終更新日:	2023-09-23
識別子（ID）:	{11-[(carboxy-kappaO)methyl]-1-oxo-1-(4-sulfamoylphenyl)-5,8-dioxa-2,11-diazatridecan-13-oato(2-)-kappaO~13~}copper

BAZ

BAZ
表記:	BIS(5-AMIDINO-BENZIMIDAZOLYL)METHANE ZINC
組成式:	C17 H16 N8 Zn
SMILES:	[Zn++].NC(=N)c1ccc2nc(Cc3[nH]c4cc(ccc4n3)C(N)=N)[nH]c2c1
InChi:	InChI=1S/C17H16N8.Zn/c18-16(19)8-1-3-10-12(5-8)24-14(22-10)7-15-23-11-4-2-9(17(20)21)6-13(11)25-15
定義日:	1999-07-08
最終更新日:	2023-09-23
識別子（ID）:	[5-carbamimidoyl-2-[(6-carbamimidoyl-1H-benzoimidazol-2-yl)methyl]-3H-benzoimidazol-1-yl]zinc

BCB

BCB
表記:	BACTERIOCHLOROPHYLL B
組成式:	C55 H72 Mg N4 O6
SMILES:	COC(=O)[CH]1C(=O)C2=C(C)C3=CC4=[N+]5C(=Cc6n7c(C=C8[CH](C)[CH](CCC(=O)OCC=C(C)CCC[CH](C)CCC[CH](C)CCCC(C)C)C9=[N+]8[Mg]57[N]3C2=C19)c(C)c6C(C)=O)[CH](C)C4=CC
InChi:	InChI=1S/C55H73N4O6.Mg/c1-13-39-34(7)41-29-46-48(38(11)60)36(9)43(57-46)27-42-35(8)40(52(58-42)50-51(55(63)64-12)54(62)49-37(10)44(59-53(49)50)28-45(39)56-41)23-24-47(61)65-26-25-33(6)22-16-21-32(5)20-15-19-31(4)18-14-17-30(2)3
定義日:	1999-07-08
最終更新日:	2023-09-23

BCL

BCL
表記:	BACTERIOCHLOROPHYLL A
組成式:	C55 H74 Mg N4 O6
SMILES:	[Mg++].CC[CH]1[CH](C)C2=Cc3[n-]c(C=C4N=C([CH](CCC(=O)OCC=C(C)CCC[CH](C)CCC[CH](C)CCCC(C)C)[CH]4C)C5=C6[N-]C(=CC1=N2)C(=C6C(=O)[CH]5C(=O)OC)C)c(C)c3C(C)=O
InChi:	InChI=1S/C55H75N4O6.Mg/c1-13-39-34(7)41-29-46-48(38(11)60)36(9)43(57-46)27-42-35(8)40(52(58-42)50-51(55(63)64-12)54(62)49-37(10)44(59-53(49)50)28-45(39)56-41)23-24-47(61)65-26-25-33(6)22-16-21-32(5)20-15-19-31(4)18-14-17-30(2)3
定義日:	1999-07-08
最終更新日:	2023-09-23

BOZ

BOZ
表記:	BIS(5-AMIDINO-BENZIMIDAZOLYL)METHANONE ZINC
組成式:	C17 H18 N8 O Zn
SMILES:	[Zn++].NC(N)c1ccc2nc([nH]c2c1)C(=O)c3[nH]c4cc(ccc4n3)C(N)N
InChi:	InChI=1S/C17H18N8O.Zn/c18-14(19)7-1-3-9-11(5-7)24-16(22-9)13(26)17-23-10-4-2-8(15(20)21)6-12(10)25-17
定義日:	1999-07-08
最終更新日:	2023-09-23
識別子（ID）:	[5-(diaminomethyl)-2-[[6-(diaminomethyl)-1H-benzoimidazol-2-yl]carbonyl]-3H-benzoimidazol-1-yl]zinc

BPT

BPT
表記:	BIS(TRANS-PLATINUM ETHYLENEDIAMINE DIAMINE CHLORO)COMPLEX
組成式:	C4 H24 Cl2 N6 Pt2
SMILES:	N.N.N.N.NCCCCN.Cl[Pt].Cl[Pt]
InChi:	InChI=1S/C4H12N2.2ClH.4H3N.2Pt/c5-3-1-2-4-6
別名:	1,1/T,T
定義日:	1999-07-08
最終更新日:	2023-09-23
識別子（ID）:	chloranyl-[4-[(chloranyl-bis($l^{4}-azanyl)platinio)-$l^{4}-azanyl]butyl-$l^{4}-azanyl]-bis($l^{4}-azanyl)platinum

BTF

BTF
表記:	iron(II) tetracyano-5-(2-Oxo-hexahydro-thieno[3,4-d]imidazol-6-yl)-pentanoic acid (4'-methyl-[2,2']bipyridinyl-4-ylmethyl)-amide
組成式:	C26 H27 Fe N9 O2 S
SMILES:	Cc1ccnc(c1)c2cc(CNC(=O)CCCC[CH]3SC[CH]4NC(=O)N[CH]34)ccn2.N#C[Fe](C#N)(C#N)C#N
InChi:	InChI=1S/C22H27N5O2S.4CN.Fe/c1-14-6-8-23-16(10-14)17-11-15(7-9-24-17)12-25-20(28)5-3-2-4-19-21-18(13-30-19)26-22(29)27-21
定義日:	2009-03-05
最終更新日:	2023-09-23
識別子（ID）:	5-[(3~{a}~{S},4~{S},6~{a}~{R})-2-oxidanylidene-1,3,3~{a},4,6,6~{a}-hexahydrothieno[3,4-d]imidazol-4-yl]-~{N}-[(8,8,8,8-tetracyano-12-methyl-7$l^{4},9$l^{4}-diaza-8$l^{6}-ferratricyclo[7.4.0.0^{2,7}]trideca-1(13),2,4,6,9,11-hexaen-4-yl)methyl]pentanamide

BVA

BVA
表記:	TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE
組成式:	C7 H9 N O5 V
SMILES:	O[V](O)(O)ONC(=O)c1ccccc1
InChi:	InChI=1S/C7H6NO2.3H2O.V/c9-7(8-10)6-4-2-1-3-5-6
定義日:	2007-04-19
最終更新日:	2023-09-23
識別子（ID）:	2,2,2-tris(oxidanyl)-5-phenyl-1$l^{3},3-dioxa-4-aza-2$l^{5}-vanadacyclopent-5-ene

C7P

C7P
表記:	cis-diammine(pyridine)chloroplatinum(II)
組成式:	C5 H11 Cl N3 Pt
SMILES:	N.N.Cl[Pt++].c1ccncc1
InChi:	InChI=1S/C5H5N.ClH.2H3N.Pt/c1-2-4-6-5-3-1
定義日:	2008-04-03
最終更新日:	2023-09-23
識別子（ID）:	chloranyl-bis($l^{4}-azanyl)-pyridin-1-yl-platinum(2+)

CLN

CLN
表記:	SULFUR SUBSTITUTED PROTOPORPHYRIN IX
組成式:	C34 H32 Fe N4 O4 S
SMILES:	CC1=C(CCC(O)=O)C2=Cc3n4[Fe][N]5C(=CC1=N2)C(=C(C=C)C5=CC6=NC(=Cc4c(C)c3CCC(O)=O)[CH]7C=CS[C]67C)C
InChi:	InChI=1S/C34H34N4O4S.Fe/c1-6-20-17(2)24-13-25-18(3)21(7-9-32(39)40)27(35-25)15-28-22(8-10-33(41)42)19(4)26(36-28)14-30-23-11-12-43-34(23,5)31(38-30)16-29(20)37-24
定義日:	1999-07-08
最終更新日:	2023-09-23

CLP

CLP
表記:	FE-S CLUSTER
組成式:	Fe8 S8
SMILES:	S1[Fe]S[Fe]2S[Fe][S]2([Fe]1)[S]34[Fe]S[Fe]S[Fe]3S[Fe]4
InChi:	InChI=1S/8Fe.S2.6S/c
定義日:	1999-07-08
最終更新日:	2023-09-23

CN1

CN1
表記:	OXO-IRON CLUSTER 2
組成式:	Fe3 H9 O12
SMILES:	O[Fe](O)O.O[Fe](O)(O)(O)O[Fe]1(O)(O)OO1
InChi:	InChI=1S/3Fe.O2.9H2O.O/c
定義日:	2003-10-16
最終更新日:	2023-09-23
識別子（ID）:	[(1~{R})-3,3-bis(oxidanyl)-1-[tris(oxidanyl)ferrio]-1$l^{3},2-dioxa-3$l^{5}-ferracycloprop-3-yl]oxy-tetrakis(oxidanyl)iron

CNF

CNF
表記:	OXO-IRON CLUSTER 3
組成式:	Fe3 H9 O12
SMILES:	O[Fe](O)(O)O[Fe]1(O)(O)O[Fe](O)(O)(O)(O)O1
InChi:	InChI=1S/3Fe.9H2O.3O/h
定義日:	2003-10-16
最終更新日:	2023-09-23
識別子（ID）:	(1~{R})-2,2,2,2,4,4,6,6,6-nonakis(oxidanyl)-1$l^{3},3,5-trioxa-2$l^{6},4$l^{5},6$l^{5}-triferrabicyclo[2.2.0]hexane

COH

COH
表記:	PROTOPORPHYRIN IX CONTAINING CO
組成式:	C34 H32 Co N4 O4
SMILES:	CC1=C(CCC(O)=O)C2=Cc3n4[Co][N]5C(=CC1=N2)C(=C(C=C)C5=CC6=NC(=Cc4c(C)c3CCC(O)=O)C(=C6C)C=C)C
InChi:	InChI=1S/C34H34N4O4.Co/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25
定義日:	1999-07-08
最終更新日:	2023-09-23

COY

COY
表記:	CO-(ADENIN-9-YL-PENTYL)-COBALAMIN
組成式:	C72 H106 Co N18 O14 P
SMILES:	C[CH](CNC(=O)CC[C]1(C)[CH](CC(N)=O)[CH]2[N-][CH]1C(=C3[CH](CCC(N)=O)C(C)(C)[CH]4C=C5[CH](CCC(N)=O)[C](C)(CC(N)=O)[CH]6[N]5[Co++](CCCCCn7cnc8c(N)ncnc78)([N]34)[N]9C(=C6C)[CH](CCC(N)=O)[C](C)(CC(N)=O)[C]29C)C)O[P](O)(=O)O[CH]%10[CH](O)[CH](O[CH]%10CO)n%11cnc%12cc(C)c(C)cc%11%12
InChi:	InChI=1S/C62H92N13O14P.C10H14N5.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56
定義日:	2000-02-16
最終更新日:	2023-09-23

CUP

CUP
表記:	(N-SALICYLIDEN-L-PHENYLALANATO)-COPPER(II)
組成式:	C16 H13 Cu N O3
SMILES:	O=C1O[Cu]Oc2ccccc2C=N[CH]1Cc3ccccc3
InChi:	InChI=1S/C16H15NO3.Cu/c18-15-9-5-4-8-13(15)11-17-14(16(19)20)10-12-6-2-1-3-7-12
定義日:	2007-02-13
最終更新日:	2023-09-23
識別子（ID）:	(6~{S})-6-(phenylmethyl)-2,4-dioxa-7$l^{4}-aza-3$l^{3}-cupratricyclo[7.4.0.0^{3,7}]trideca-1(13),7,9,11-tetraen-5-one

CUS

CUS
表記:	(N-SALICYLIDEN-L-LEUCINATO)-COPPER(II)
組成式:	C13 H15 Cu N O3
SMILES:	CC(C)C[CH]1N=Cc2ccccc2O[Cu]OC1=O
InChi:	InChI=1S/C13H17NO3.Cu/c1-9(2)7-11(13(16)17)14-8-10-5-3-4-6-12(10)15
定義日:	2007-02-15
最終更新日:	2023-09-23
識別子（ID）:	(6~{S})-6-(2-methylpropyl)-2,4-dioxa-7$l^{4}-aza-3$l^{3}-cupratricyclo[7.4.0.0^{3,7}]trideca-1(13),7,9,11-tetraen-5-one

DW1

DW1
表記:	Ruthenium pyridocarbazole
組成式:	C23 H13 N3 O4 Ru
SMILES:	OC1=CC2=C3C(=C4N([Ru]C5C=CC=C5)C=CC=C4C6=C3C(=O)NC6=O)N=C2C=C1.[C-]#[O+]
InChi:	InChI=1S/C17H9N3O3.C5H5.CO.Ru/c21-7-3-4-10-9(6-7)11-13-12(16(22)20-17(13)23)8-2-1-5-18-14(8)15(11)19-10
定義日:	2009-02-23
最終更新日:	2023-09-23

DW2

DW2
表記:	RU-PYRIDOCARBAZOLE-2
組成式:	C23 H13 N3 O4 Ru
SMILES:	Oc1ccc2n([Ru]C3C=CC=C3)c4c5ncccc5c6C(=O)NC(=O)c6c4c2c1.[C-]#[O+]
InChi:	InChI=1S/C17H9N3O3.C5H5.CO.Ru/c21-7-3-4-10-9(6-7)11-13-12(16(22)20-17(13)23)8-2-1-5-18-14(8)15(11)19-10
定義日:	2005-08-18
最終更新日:	2023-09-23

DWC

DWC
表記:	PYRIDOCARBAZOLE CYCLOPENTADIENYL OS(CO) COMPLEX
組成式:	C23 H9 N3 O4 Os
SMILES:	Oc1ccc2n3[Os](C#[O+])[n+]4cccc5c6C(=O)NC(=O)c6c(c2c1)c3c45.C7C=CC=C7
InChi:	InChI=1S/C17H9N3O3.C5H.CO.Os/c21-7-3-4-10-9(6-7)11-13-12(16(22)20-17(13)23)8-2-1-5-18-14(8)15(11)19-10
定義日:	2008-01-18
最終更新日:	2023-09-23

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