Name: Mesobiliverdin (microbial source)
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219586475
Cas No:493-88-9
常用名:Mesobiliverdin (microbial source)
常用名:Mesobiliverdin (microbial source)
别名:Mesobiliverdin (microbial source), Glaucobilin
别名:Mesobiliverdin (microbial source), Glaucobilin
IUPAC:3-(2-{[(2Z)-3-(2-carboxyethyl)-5-{[(2Z)-4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-2H-pyrrol-2-ylidene]methyl}-5-{[(2Z)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid
IUPAC:3-(2-{[(2Z)-3-(2-carboxyethyl)-5-{[(2Z)-4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-2H-pyrrol-2-ylidene]methyl}-5-{[(2Z)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid
InChI key:CXQHEXWJGZEPFP-BBROENKCSA-N

分子式:C33H38N4O6
分子量:586.689
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCC1=C(C)\C(NC1=O)=C\C1=N\C(=C/c2[nH]c(\C=C3/NC(=O)C(C)=C3CC)c(C)c2CCC(O)=O)\C(CCC(O)=O)=C1C
SMILES:CCC1=C(C)\C(NC1=O)=C\C1=N\C(=C/c2[nH]c(\C=C3/NC(=O)C(C)=C3CC)c(C)c2CCC(O)=O)\C(CCC(O)=O)=C1C

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