[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid
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![[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/52502fd553b24703806240a5ca8c427b.png "[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid")
[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid
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CAS No:
174740-63-7
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Formula:
C42H70N2O5
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Chemical Name:
[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid
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Synonyms:
174740-63-7;Betulinic acid NH-HepNHCOPrCOOH deriv.;DTXSID40938575;((N-(3beta-Hydroxylup-20(29)-en-28-oyl)-7-aminoheptyl)carbamoyl)butanoic acid;Pentanoic acid, 5-((7-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)heptyl)amino)-5-oxo-;[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid;5-[(7-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}heptyl)imino]-5-hydroxypentanoic acid;5-[7-[[(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]heptylamino]-5-oxo-pentanoic acid;Pentanoic acid, 5-[[7-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]heptyl]amino]-5-oxo-
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CAS No:
[[N-[3.beta.-Hydroxylup-20(29)-en-28-oyl]-7-aminoheptyl]carbamoyl]butanoic acid Basic Attributes
683.0 g/mol
682.52847334 g/mol
Computed Properties
Molecular Weight:683.0
XLogP3:9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:14
Exact Mass:682.52847334
Monoisotopic Mass:682.52847334
Topological Polar Surface Area:116
Heavy Atom Count:49
Complexity:1250
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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