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Deoxycholyltyrosine

Deoxycholyltyrosine structure

CAS No:
103528-66-1
Formula:
C33H49NO6
Chemical Name:
Deoxycholyltyrosine
Synonyms:
deoxycholyltyrosine;Deoxycholyltyrosine;103528-66-1;DTXSID00908456;(2S)-2-[[(4R)-4-[(3R,5R,10S,12S,13R,17R)-3,12-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;N-(3,12,24-Trihydroxycholan-24-ylidene)tyrosine

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Deoxycholyltyrosine Basic Attributes

Molecular Weight：

555.7 g/mol

Exact Mass：

555.35598828 g/mol

Characteristics

PSA：

127 Å²

Drug Information

MeSH Entry Terms：

deoxycholyltyrosine

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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Guide of Deoxycholyltyrosine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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