N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid
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![N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/16d9ac8223b54727b97b4b575705718e.png "N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid")
N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid
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CAS No:
174740-46-6
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Formula:
C43H72N2O5
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Chemical Name:
N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid
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Synonyms:
174740-46-6;Betulinic acid NH-HepCONHBuCOOH deriv.;DTXSID90938560;N'-(N-(3beta-Hydroxylup-20(29)-en-28-oyl)-8-aminooctanoyl)-5-aminopentanoic acid;Pentanoic acid, 5-((8-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-;N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid;5-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]pentanoic acid;5-[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]pentanoic acid;Pentanoic acid, 5-[[8-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-1-oxooctyl]amino]-
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CAS No:
N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-8-aminooctanoyl]-5-aminopentanoic acid Basic Attributes
697.0 g/mol
696.54412340 g/mol
Computed Properties
Molecular Weight:697.0
XLogP3:9.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:15
Exact Mass:696.54412340
Monoisotopic Mass:696.54412340
Topological Polar Surface Area:116
Heavy Atom Count:50
Complexity:1260
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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