2-[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropyl]sulfanyl-3-methylpentanoic acid
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![2-[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropyl]sulfanyl-3-methylpentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/67e0e763977a4cd09ded021622ec666d.png "2-[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropyl]sulfanyl-3-methylpentanoic acid")
2-[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropyl]sulfanyl-3-methylpentanoic acid
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CAS No:
103834-43-1
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Formula:
C29H40N4O6S
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Chemical Name:
2-[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropyl]sulfanyl-3-methylpentanoic acid
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Synonyms:
Tagppl; tyrosylalanyl-N-{1-[(1-carboxy-2-methylbutyl)sulfanyl]-3-phenylpropan-2-yl}glycinamide;
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CAS No:
2-[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropyl]sulfanyl-3-methylpentanoic acid Basic Attributes
572.71600
572.26685618 g/mol
Computed Properties
Molecular Weight:572.7
XLogP3:1.1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:16
Exact Mass:572.26685618
Monoisotopic Mass:572.26685618
Topological Polar Surface Area:196
Heavy Atom Count:40
Complexity:816
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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