Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-
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![Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/23dad5a9332d499191bda918ad2c4d14.png "Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-")
Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-
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CAS No:
174740-44-4
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Formula:
C43H73NO4
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Chemical Name:
Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-
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Synonyms:
174740-44-4;Betulinic acid NH-DodecCOOH deriv.;DTXSID80938559;N-(3beta-Hydroxylup-20(29)-en-28-oyl)-13-aminotridecanoic acid;Tridecanoic acid, 13-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-;N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-13-aminotridecanoic acid;13-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}tridecanoic acid;Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-;13-[[(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]tridecanoic acid
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CAS No:
Tridecanoic acid, 13-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]- Basic Attributes
668.0 g/mol
667.55395981 g/mol
Computed Properties
Molecular Weight:668.0
XLogP3:12.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:15
Exact Mass:667.55395981
Monoisotopic Mass:667.55395981
Topological Polar Surface Area:86.6
Heavy Atom Count:48
Complexity:1160
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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