CAFFEIC ACID-PYEEIE
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CAFFEIC ACID-PYEEIE
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CAS No:
507471-72-9
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Formula:
C39H50N5O19P
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Chemical Name:
CAFFEIC ACID-PYEEIE
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Synonyms:
N-[3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL]-O-PHOSPHONO-L-TYROSYL-L-ALPHA-GLUTAMYL-L-ALPHA-GLUTAMYL-L-ISOLEUCYL-L-GLUTAMIC ACID;CAFFEIC ACID-PYEEIE;N-[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]-O-phosphono-L-tyrosyl-L-a-glutamyl-L-a-glutamyl-L-isoleucyl-L-glutamicacid;N-[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]-O-phosphono-L-tyrosyl-L-α-glutamyl-L-α-glutamyl-L-isoleucyl-L-glutamicacid
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CAS No:
Computed Properties
Molecular Weight:923.8
XLogP3:-0.4
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:27
Exact Mass:923.28376138
Monoisotopic Mass:923.28376138
Topological Polar Surface Area:402
Heavy Atom Count:64
Complexity:1730
Undefined Atom Stereocenter Count:6
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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