Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-
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![Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/eb81edb2cbe14ba997ac495f266129f0.png "Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-")
Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-
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CAS No:
174740-43-3
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Formula:
C39H65NO4
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Chemical Name:
Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-
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Synonyms:
174740-43-3;Betulinic acid NH-OctCOOH deriv.;DTXSID20938558;N-(3beta-Hydroxylup-20(29)-en-28-oyl)-9-aminonononanoic acid;Nonanoic acid, 9-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-;9-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}nonanoic acid;N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-9-aminonononanoic acid;Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-;9-[[(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]nonanoic acid
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CAS No:
Nonanoic acid, 9-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]- Basic Attributes
611.9 g/mol
611.49135955 g/mol
Computed Properties
Molecular Weight:611.9
XLogP3:10.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:11
Exact Mass:611.49135955
Monoisotopic Mass:611.49135955
Topological Polar Surface Area:86.6
Heavy Atom Count:44
Complexity:1100
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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