3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid
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![3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/350c40381a17416ea9015e3fa95b46d5.png "3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid")
3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid
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CAS No:
174740-54-6
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Formula:
C42H67F3N2O5
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Chemical Name:
3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid
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Synonyms:
174740-54-6;DTXSID50938566;(3R,S)-N'-(N-3beta-Hydroxylup-20(29)-en-28-oyl)-8-aminooctanoyl)-3-amino-4,4,4-trifluorobutyric acid;Butanoic acid, 4,4,4-trifluoro-3-((8-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-;(3R,S)-N'-[N-3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-3-amino-4,4,4-trifluorobutyric acid;3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid;3-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]-4,4,4-trifluoro-butanoic acid;Butanoic acid, 4,4,4-trifluoro-3-[[8-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-1-oxooctyl]amino]-
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CAS No:
3-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-4,4,4-trifluorobutanoic acid Basic Attributes
737.0 g/mol
736.50020773 g/mol
Computed Properties
Molecular Weight:737.0
XLogP3:10
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:13
Exact Mass:736.50020773
Monoisotopic Mass:736.50020773
Topological Polar Surface Area:116
Heavy Atom Count:52
Complexity:1370
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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