N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid
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![N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ee3ac8774f4a4cffb8550bf474c634f0.png "N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid")
N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid
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CAS No:
150840-72-5
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Formula:
C40H66N2O5
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Chemical Name:
N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid
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Synonyms:
150840-72-5;Betulinic acid NH-PenCONH-PrCOOH deriv.;DTXSID00934098;N'-(N-(3beta-Hydroxylup-20(29)-en-28-oyl)-6-aminohexanoyl)-4-aminobutyric acid;Butanoic acid, 4-((6-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxohexyl)amino)-;N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid;4-[(6-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyhexylidene)amino]butanoic acid;4-[6-[[(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]hexanoylamino]butanoic acid;Butanoic acid, 4-[[6-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-1-oxohexyl]amino]-
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CAS No:
N'-[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-6-aminohexanoyl]-4-aminobutyric acid Basic Attributes
655.0 g/mol
654.49717321 g/mol
Computed Properties
Molecular Weight:655.0
XLogP3:8.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:12
Exact Mass:654.49717321
Monoisotopic Mass:654.49717321
Topological Polar Surface Area:116
Heavy Atom Count:47
Complexity:1210
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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