PUBCHEM_54604262

HCID 54604262

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基本情報

CAS: 55317-87-8
標準SMILES: C/C1=C2N=C(/C=C3N=C(/C(C)=C4\[N-]C(C(CC(N)=O)C4(C)CCC(=O)NCC(C)OP(=O)(O)OC4C(CO)OC(n5cnc6cc(C)c(C)cc65)C4O)C4(C)N=C1C(CCC(N)=O)C4(C)CC(N)=O)C(CCC(N)=O)C\3(C)C)C(CCC(N)=O)C/2(C)CC(N)=O.[CH2-]C1OC(c2[nH]nc3c(N)ncnc23)C(O)C1O.[Co+2]
InChIKey: LZTSNVLGDJCVTJ-UHFFFAOYSA-M
分子式: C72H101CoN18O17P
平均分子量: 1,580.616 g/mol
単同位体質量: 1,579.6661654

優先名称: PUBCHEM_54604262
IUPAC: Cobalt(2+) [5-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-3,4-dihydroxyoxolan-2-yl]methanide (6Z,11Z,16Z)-3,8,19-tris(2-amino-2-oxoethyl)-4,9,14-tris(3-amino-3-oxopropyl)-18-{3-[(2-{[{[5-(5,6-dimethyl-1H-benzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)phosphoryl]oxy}propyl)amino]-3-oxopropyl}-2,3,6,8,13,13,16,18-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1~2,5~.1~7,10~.1~12,15~]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-ide (1/1/1)

読み込み中…

CAS: 55317-87-8
標準SMILES: C/C1=C2N=C(/C=C3N=C(/C(C)=C4\[N-]C(C(CC(N)=O)C4(C)CCC(=O)NCC(C)OP(=O)(O)OC4C(CO)OC(n5cnc6cc(C)c(C)cc65)C4O)C4(C)N=C1C(CCC(N)=O)C4(C)CC(N)=O)C(CCC(N)=O)C\3(C)C)C(CCC(N)=O)C/2(C)CC(N)=O.[CH2-]C1OC(c2[nH]nc3c(N)ncnc23)C(O)C1O.[Co+2]
InChIKey: LZTSNVLGDJCVTJ-UHFFFAOYSA-M
分子式: C72H101CoN18O17P
平均分子量: 1,580.616 g/mol
単同位体質量: 1,579.6661654

優先名称: PUBCHEM_54604262
IUPAC: Cobalt(2+) [5-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-3,4-dihydroxyoxolan-2-yl]methanide (6Z,11Z,16Z)-3,8,19-tris(2-amino-2-oxoethyl)-4,9,14-tris(3-amino-3-oxopropyl)-18-{3-[(2-{[{[5-(5,6-dimethyl-1H-benzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)phosphoryl]oxy}propyl)amino]-3-oxopropyl}-2,3,6,8,13,13,16,18-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1~2,5~.1~7,10~.1~12,15~]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-ide (1/1/1)

読み込み中…