Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-propanoate, (3α,4β,8α)-
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Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-propanoate, (3α,4β,8α)-
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CAS No:
111112-47-1
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Formula:
C22H30O9
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Chemical Name:
Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-propanoate, (3α,4β,8α)-
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Synonyms:
Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-,4,15-diacetate 8-propanoate,(3α,4β,8α)-;Spiro[2,5-methano-1-benzoxepin-10,2′-oxirane],trichothec-9-ene-3,4,8,15-tetrol deriv.;8-Propionylneosolaniol;Neosolaniol 8-propionate;116163-71-4
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CAS No:
Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-propanoate, (3α,4β,8α)- Basic Attributes
438.5 g/mol
438.47
Computed Properties
Molecular Weight:438.5
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:438.18898253
Monoisotopic Mass:438.18898253
Topological Polar Surface Area:121
Heavy Atom Count:31
Complexity:837
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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