Name: Bilirubin
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT100538912
Cas No:635-65-4
常用名:Bilirubin
别名:胆红素, Principal bile pigment, Hemetoidin, Hematoidin, Bilibubin
别名:胆红素, Principal bile pigment, Hemetoidin, Hematoidin, Bilibubin
IUPAC:3-(2-{[3-(2-carboxyethyl)-5-{[(2Z)-4-ethenyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-2-yl]methyl}-5-{[(2Z)-3-ethenyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid
IUPAC:3-(2-{[3-(2-carboxyethyl)-5-{[(2Z)-4-ethenyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-2-yl]methyl}-5-{[(2Z)-3-ethenyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid
InChI key:BPYKTIZUTYGOLE-IFADSCNNSA-N

分子式:C33H36N4O6
分子量:584.673
氢键供体数 (HBD):6
氢键受体数 (HBA):10
LogP:3.275
SMILES:CC1=C(C=C)\C(NC1=O)=C\c1[nH]c(Cc2[nH]c(\C=C3/NC(=O)C(C=C)=C3C)c(C)c2CCC(O)=O)c(CCC(O)=O)c1C
SMILES:CC1=C(C=C)\C(NC1=O)=C\c1[nH]c(Cc2[nH]c(\C=C3/NC(=O)C(C=C)=C3C)c(C)c2CCC(O)=O)c(CCC(O)=O)c1C

Bilirubin (Principal bile pigment) 是胆色素的一种，是血液中血红素的代谢产物。Bilirubin 具有抗诱变和抗氧化作用。Bilirubin 是临床上判定黄疸的重要依据，也是肝功能的重要指标。

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