Chemical Compound

3-((3S,12R,19S,25R,28S,31E,34S,37R,40S)-37-((2S)-Butan-2-yl)-31-ethylidene-11,14,15,18,27,30,33,36,39-nonahydroxy-16-(4-hydroxy-2-(((2S)-4-methyl-2-(N-methylacetamido)pentanoyl)oxy)-5-phenylpentyl)-28-((1R)-1-hydroxyethyl)-34-(hydroxymethyl)-25-(2-(4-methoxyphenyl)ethyl)-2,8,24-trioxo-1,7,10,13,17,23,26,29,32,35,38-undecaazatetracyclo(38.3.0.0,.0,)tritetraconta-10,13,17,26,29,32,35,38-octaen-12-yl)propanimidate

返回搜索 申请报价
3-((3S,12R,19S,25R,28S,31E,34S,37R,40S)-37-((2S)-Butan-2-yl)-31-ethylidene-11,14,15,18,27,30,33,36,39-nonahydroxy-16-(4-hydroxy-2-(((2S)-4-methyl-2-(N-methylacetamido)pentanoyl)oxy)-5-phenylpentyl)-28-((1R)-1-hydroxyethyl)-34-(hydroxymethyl)-25-(2-(4-methoxyphenyl)ethyl)-2,8,24-trioxo-1,7,10,13,17,23,26,29,32,35,38-undecaazatetracyclo(38.3.0.0,.0,)tritetraconta-10,13,17,26,29,32,35,38-octaen-12-yl)propanimidate 结构式
Primary record

3-((3S,12R,19S,25R,28S,31E,34S,37R,40S)-37-((2S)-Butan-2-yl)-31-ethylidene-11,14,15,18,27,30,33,36,39-nonahydroxy-16-(4-hydroxy-2-(((2S)-4-methyl-2-(N-methylacetamido)pentanoyl)oxy)-5-phenylpentyl)-28-((1R)-1-hydroxyethyl)-34-(hydroxymethyl)-25-(2-(4-methoxyphenyl)ethyl)-2,8,24-trioxo-1,7,10,13,17,23,26,29,32,35,38-undecaazatetracyclo(38.3.0.0,.0,)tritetraconta-10,13,17,26,29,32,35,38-octaen-12-yl)propanimidate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
139586415
SMILES
CC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)NC(C(C(=O)N[C@@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N1)CCC(=O)N)O)CC(CC(CC5=CC=CC=C5)O)OC(=O)[C@H](CC(C)C)N(C)C(=O)C)CCC6=CC=C(C=C6)OC)[C@@H](C)O)CO
Canonical SMILES
C/C=C1/NC(=O)[C@H](CO)NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H](CCC(N)=O)NC(=O)C(O)C(CC(CC(O)Cc2ccccc2)OC(=O)[C@H](CC(C)C)N(C)C(C)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCc2ccc(OC)cc2)NC(=O)[C@H]([C@@H](C)O)NC1=O

名称与同义词

  • Tychonamide A
  • RefChem:192619
  • SCHEMBL29885576
  • CHEBI:221770
  • DTXSID701046581
  • [1-[(3S,12R,19S,25R,28S,31E,34S,37R,40S)-12-(3-amino-3-oxopropyl)-37-[(2S)-butan-2-yl]-31-ethylidene-15-hydroxy-28-[(1R)-1-hydroxyethyl]-34-(hydroxymethyl)-25-[2-(4-methoxyphenyl)ethyl]-2,8,11,14,18,24,27,30,33,36,39-undecaoxo-1,7,10,13,17,23,26,29,32,35,38-undecazatetracyclo[38.3.0.03,7.019,23]tritetracontan-16-yl]-4-hydroxy-5-phenylpentan-2-yl] (2S)-2-[acetyl(methyl)amino]-4-methylpentanoate
  • (1-((3S,12R,19S,25R,28S,31E,34S,37R,40S)-12-(3-amino-3-oxopropyl)-37-((2S)-butan-2-yl)-31-ethylidene-15-hydroxy-28-((1R)-1-hydroxyethyl)-34-(hydroxymethyl)-25-(2-(4-methoxyphenyl)ethyl)-2,8,11,14,18,24,27,30,33,36,39-undecaoxo-1,7,10,13,17,23,26,29,32,35,38-undecazatetracyclo(38.3.0.03,7.019,23)tritetracontan-16-yl)-4-hydroxy-5-phenylpentan-2-yl) (2S)-2-(acetyl(methyl)amino)-4-methylpentanoate
  • 1-((6R,9S,15S,18R,20aS,25aS,34R,40aS,E)-34-(3-amino-3-oxopropyl)-18-((S)-sec-butyl)-12-ethylidene-37-hydroxy-9-((R)-1-hydroxyethyl)-15-(hydroxymethyl)-6-(4-methoxyphenethyl)-5,8,11,14,17,20,25,30,33,36,40-undecaoxooctatriacontahydro-1H,25H-tripyrrolo(1,2-b1:1',2'-g:1'',2''-j)(1,4,7,10,13,16,19,22,25,28,31)undecaazacyclotetratriacontin-38-yl)-4-hydroxy-5-phenylpentan-2-yl N-acetyl-N-methyl-L-leucinate
  • 1-((6R,9S,15S,18R,20aS,25aS,34R,40aS,E)-34-(3-amino-3-oxopropyl)-18-((S)-sec-butyl)-12-ethylidene-37-hydroxy-9-((R)-1-hydroxyethyl)-15-(hydroxymethyl)-6-(4-methoxyphenethyl)-5,8,11,14,17,20,25,30,33,36,40-undecaoxooctatriacontahydro-1H,25H-tripyrrolo[1,2-b1:1',2'-g:1'',2''-j][1,4,7,10,13,16,19,22,25,28,31]undecaazacyclotetratriacontin-38-yl)-4-hydroxy-5-phenylpentan-2-yl N-acetyl-N-methyl-L-leucinate
  • 3-((3S,12R,19S,25R,28S,31E,34S,37R,40S)-37-((2S)-Butan-2-yl)-31-ethylidene-11,14,15,18,27,30,33,36,39-nonahydroxy-16-(4-hydroxy-2-(((2S)-4-methyl-2-(N-methylacetamido)pentanoyl)oxy)-5-phenylpentyl)-28-((1R)-1-hydroxyethyl)-34-(hydroxymethyl)-25-(2-(4-methoxyphenyl)ethyl)-2,8,24-trioxo-1,7,10,13,17,23,26,29,32,35,38-undecaazatetracyclo(38.3.0.0,.0,)tritetraconta-10,13,17,26,29,32,35,38-octaen-12-yl)propanimidate
  • 3-[(3S,12R,19S,25R,28S,31E,34S,37R,40S)-37-[(2S)-Butan-2-yl]-31-ethylidene-11,14,15,18,27,30,33,36,39-nonahydroxy-16-(4-hydroxy-2-{[(2S)-4-methyl-2-(N-methylacetamido)pentanoyl]oxy}-5-phenylpentyl)-28-[(1R)-1-hydroxyethyl]-34-(hydroxymethyl)-25-[2-(4-methoxyphenyl)ethyl]-2,8,24-trioxo-1,7,10,13,17,23,26,29,32,35,38-undecaazatetracyclo[38.3.0.0,.0,]tritetraconta-10,13,17,26,29,32,35,38-octaen-12-yl]propanimidate