Batzelladine A
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Batzelladine A
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CAS No:
147664-18-4
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Formula:
C42H73N9O4
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Chemical Name:
Batzelladine A
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Synonyms:
1H-5,6,8b-Triazaacenaphthylene-3-carboxylic acid,2,2a,3,4,5,7,8,8a-octahydro-4-methyl-7-nonyl-,9-[(3R)-1-amino-4-[[4-[(aminoiminomethyl)amino]butoxy]carbonyl]-3,5,6,7-tetrahydropyrrolo[1,2-c]pyrimidin-3-yl]nonyl ester,(2aS,3S,4R,7R,8aS)-;1H-5,6,8b-Triazaacenaphthylene-3-carboxylic acid,2,2a,3,4,5,7,8,8a-octahydro-4-methyl-7-nonyl-,9-[1-amino-4-[[4-[(aminoiminomethyl)amino]butoxy]carbonyl]-3,5,6,7-tetrahydropyrrolo[1,2-c]pyrimidin-3-yl]nonyl ester,(2aα,3β,4β,7α,8aβ)-;Pyrrolo[1,2-c]pyrimidine,1H-5,6,8b-triazaacenaphthylene-3-carboxylic acid deriv.;Batzelladine A;(+)-Batzelladine A
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CAS No:
Computed Properties
Molecular Weight:768.1
XLogP3:6.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:27
Exact Mass:767.57855184
Monoisotopic Mass:767.57855184
Topological Polar Surface Area:186
Heavy Atom Count:55
Complexity:1360
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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