Urotensin I (BioDeep_00000184881)
human metabolite blood metabolite
代谢物信息卡片
化学式: C106H177N35O35S (2532.2866)
中文名称:
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CCC(C)C(NC(=O)C(CCCNC(N)=N)NC(=O)C(C)NC(=O)C(N)CCSC)C(=O)NC(CCC(O)=O)C(=O)NC(CC(N)=O)C(=O)NC(CCC(O)=O)C(=O)NC(CCCNC(N)=N)C(=O)NC(CCC(O)=O)C(=O)NC(CCC(N)=O)C(=O)NC(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(=O)NC(CCCNC(N)=N)C(=O)NC(CCCCN)C(=O)NC(CC1=CC=C(O)C=C1)C(=O)NC(CC(C)C)C(=O)NC(CC(O)=O)C(=O)NC(CCC(O)=O)C(=O)NC(C(C)C)C(N)=O
InChI: InChI=1S/C106H177N35O35S/c1-12-52(8)83(141-95(168)61(21-17-40-121-106(117)118)126-86(159)54(10)123-87(160)57(108)36-41-177-11)103(176)134-65(29-34-79(151)152)94(167)137-70(45-74(110)144)101(174)132-64(28-33-78(149)150)92(165)128-59(19-15-38-119-104(113)114)90(163)131-63(27-32-77(147)148)93(166)130-62(26-31-73(109)143)88(161)124-53(9)85(158)122-48-76(146)125-67(42-49(2)3)97(170)138-71(46-75(111)145)100(173)129-60(20-16-39-120-105(115)116)89(162)127-58(18-13-14-37-107)91(164)136-69(44-55-22-24-56(142)25-23-55)99(172)135-68(43-50(4)5)98(171)139-72(47-81(155)156)102(175)133-66(30-35-80(153)154)96(169)140-82(51(6)7)84(112)157/h22-25,49-54,57-72,82-83,142H,12-21,26-48,107-108H2,1-11H3,(H2,109,143)(H2,110,144)(H2,111,145)(H2,112,157)(H,122,158)(H,123,160)(H,124,161)(H,125,146)(H,126,159)(H,127,162)(H,128,165)(H,129,173)(H,130,166)(H,131,163)(H,132,174)(H,133,175)(H,134,176)(H,135,172)(H,136,164)(H,137,167)(H,138,170)(H,139,171)(H,140,169)(H,141,168)(H,147,148)(H,149,150)(H,151,152)(H,153,154)(H,155,156)(H4,113,114,119)(H4,115,116,120)(H4,117,118,121)
描述信息
同义名列表
5 个代谢物同义名
4-{[2-({2-[(2-{[6-amino-2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-amino-1-hydroxy-4-(methylsulphanyl)butylidene]amino}-1-hydroxypropylidene)amino]-5-carbamimidamido-1-hydroxypentylidene}amino)-1-hydroxy-3-methylpentylidene]amino}-4-carboxy-1-hydroxybutylidene)amino]-1-hydroxy-3-(C-hydroxycarbonimidoyl)propylidene}amino)-4-carboxy-1-hydroxybutylidene]amino}-5-carbamimidamido-1-hydroxypentylidene)amino]-4-carboxy-1-hydroxybutylidene}amino)-1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-4-methylpentylidene]amino}-1-hydroxy-3-(C-hydroxycarbonimidoyl)propylidene)amino]-5-carbamimidamido-1-hydroxypentylidene}amino)-1-hydroxyhexylidene]amino}-1-hydroxy-3-(4-hydroxyphenyl)propylidene)amino]-1-hydroxy-4-methylpentylidene}amino)-3-carboxy-1-hydroxypropylidene]amino}-4-{[1-(C-hydroxycarbonimidoyl)-2-methylpropyl]-C-hydroxycarbonimidoyl}butanoic acid; 4-{[2-({2-[(2-{[6-amino-2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-amino-1-hydroxy-4-(methylsulphanyl)butylidene]amino}-1-hydroxypropylidene)amino]-5-carbamimidamido-1-hydroxypentylidene}amino)-1-hydroxy-3-methylpentylidene]amino}-4-carboxy-1-hydroxybutylidene)amino]-1-hydroxy-3-(C-hydroxycarbonimidoyl)propylidene}amino)-4-carboxy-1-hydroxybutylidene]amino}-5-carbamimidamido-1-hydroxypentylidene)amino]-4-carboxy-1-hydroxybutylidene}amino)-1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-4-methylpentylidene]amino}-1-hydroxy-3-(C-hydroxycarbonimidoyl)propylidene)amino]-5-carbamimidamido-1-hydroxypentylidene}amino)-1-hydroxyhexylidene]amino}-1-hydroxy-3-(4-hydroxyphenyl)propylidene)amino]-1-hydroxy-4-methylpentylidene}amino)-3-carboxy-1-hydroxypropylidene]amino}-4-{[1-(C-hydroxycarbonimidoyl)-2-methylpropyl]-C-hydroxycarbonimidoyl}butanoate; 4-{[2-({2-[(2-{[6-amino-2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-({2-[(2-{[2-amino-1-hydroxy-4-(methylsulfanyl)butylidene]amino}-1-hydroxypropylidene)amino]-5-carbamimidamido-1-hydroxypentylidene}amino)-1-hydroxy-3-methylpentylidene]amino}-4-carboxy-1-hydroxybutylidene)amino]-1-hydroxy-3-(C-hydroxycarbonimidoyl)propylidene}amino)-4-carboxy-1-hydroxybutylidene]amino}-5-carbamimidamido-1-hydroxypentylidene)amino]-4-carboxy-1-hydroxybutylidene}amino)-1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-4-methylpentylidene]amino}-1-hydroxy-3-(C-hydroxycarbonimidoyl)propylidene)amino]-5-carbamimidamido-1-hydroxypentylidene}amino)-1-hydroxyhexylidene]amino}-1-hydroxy-3-(4-hydroxyphenyl)propylidene)amino]-1-hydroxy-4-methylpentylidene}amino)-3-carboxy-1-hydroxypropylidene]amino}-4-{[1-(C-hydroxycarbonimidoyl)-2-methylpropyl]-C-hydroxycarbonimidoyl}butanoate; 4-[2-(2-{2-[6-amino-2-(2-{2-[2-(2-{2-[2-(2-{2-[2-(2-{2-[2-(2-{2-[2-amino-4-(methylsulfanyl)butanamido]propanamido}-5-carbamimidamidopentanamido)-3-methylpentanamido]-4-carboxybutanamido}-3-carbamoylpropanamido)-4-carboxybutanamido]-5-carbamimidamidopentanamido}-4-carboxybutanamido)-4-carbamoylbutanamido]propanamido}acetamido)-4-methylpentanamido]-3-carbamoylpropanamido}-5-carbamimidamidopentanamido)hexanamido]-3-(4-hydroxyphenyl)propanamido}-4-methylpentanamido)-3-carboxypropanamido]-4-[(1-carbamoyl-2-methylpropyl)carbamoyl]butanoic acid; Urotensin I
相关代谢途径
Reactome(0)
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代谢反应
0 个相关的代谢反应过程信息。
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BioCyc(0)
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Plant Reactome(0)
INOH(0)
PlantCyc(0)
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1 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：
- PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。
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