chenodeoxycholyltyrosine
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chenodeoxycholyltyrosine
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CAS No:
103528-65-0
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Formula:
C33H49NO6
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Chemical Name:
chenodeoxycholyltyrosine
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Synonyms:
chenodeoxycholyltyrosine;103528-65-0;Chenodeoxycholyltyrosine;DTXSID40908455;N-(3,7,24-Trihydroxycholan-24-ylidene)tyrosine;(2S)-2-[[(4R)-4-[(3R,5S,7R,10S,13R,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
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CAS No:
Computed Properties
Molecular Weight:555.7
XLogP3:5.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:555.35598828
Monoisotopic Mass:555.35598828
Topological Polar Surface Area:127
Heavy Atom Count:40
Complexity:919
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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