3-[5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid
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![3-[5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d6a25cbda5074f13af5275a1073d0f52.png "3-[5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid")
3-[5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid
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CAS No:
15770-19-1
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Formula:
C17H22N2O3
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Chemical Name:
3-[5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid
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Synonyms:
Xanthobilirubic acid; 3-[5-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-pyrrol-2-ylidenemethyl)-2,4-dimethyl-pyrrol-3-yl]-propionic acid; 3-[5-(3-Aethyl-4-methyl-5-oxo-1,5-dihydro-pyrrol-2-ylidenmethyl)-2,4-dimethyl-pyrrol-3-yl]-propionsaeure; 5-((3-Ethyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-propanoic acid;
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CAS No:
3-[5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propanoic acid Basic Attributes
302.36800
302.16304257
Computed Properties
Molecular Weight:302.37
XLogP3:1.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:302.16304257
Monoisotopic Mass:302.16304257
Topological Polar Surface Area:82.2
Heavy Atom Count:22
Complexity:536
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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