Verruculogen TR 2
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Verruculogen TR 2
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CAS No:
51177-07-2
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Formula:
C22H27N3O6
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Chemical Name:
Verruculogen TR 2
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Synonyms:
5H,14H-Pyrrolo[1′′,2′′:4′,5′]pyrazino[1′,2′:1,6]pyrido[3,4-b]indole-5,14-dione,1,2,3,5a,6,11,12,14a-octahydro-5a,6-dihydroxy-12-(2-hydroxy-2-methylpropyl)-9-methoxy-,(5aR,6S,12S,14aS)-;5H,14H-Pyrrolo[1′′,2′′:4′,5′]pyrazino[1′,2′:1,6]pyrido[3,4-b]indole-5,14-dione,1,2,3,5a,6,11,12,14a-octahydro-5a,6-dihydroxy-12-(2-hydroxy-2-methylpropyl)-9-methoxy-,[5aR-(5aα,6α,12β,14aα)]-;(5aR,6S,12S,14aS)-1,2,3,5a,6,11,12,14a-Octahydro-5a,6-dihydroxy-12-(2-hydroxy-2-methylpropyl)-9-methoxy-5H,14H-pyrrolo[1′′,2′′:4′,5′]pyrazino[1′,2′:1,6]pyrido[3,4-b]indole-5,14-dione;TR 2;Verruculogen TR 2;NSC 353637;TR 2 (toxin);N1-Desacylasperfumigatin
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CAS No:
Computed Properties
Molecular Weight:429.5
XLogP3:-0.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:429.18998559
Monoisotopic Mass:429.18998559
Topological Polar Surface Area:126
Heavy Atom Count:31
Complexity:776
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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