15-ACETOXY-3ALPHA,4BETA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE
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15-ACETOXY-3ALPHA,4BETA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE
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CAS No:
2623-22-5
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Formula:
C17H24O6
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Chemical Name:
15-ACETOXY-3ALPHA,4BETA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE
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Synonyms:
deacetylanguidin;15-ACETOXY-3ALPHA,4BETA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE;15-ACETOXYSCIRPENDIOL;15-ACETOXYSCIRPENOL;(3-alpha)-12,13-epoxytrichothec-9-ene-3,4,15-triol15-acetate;15-mas;4-beta,15-triol,12,13-epoxy-trichothec-9-ene-3-alph15-acetate;((2R,2S,3R,5R,5AR,9aR)-3-hydroxy-5,8-dimethyl-2,3,4,5,5a,6,7,9a-octahydrospiro[2,5-methanobenzo[b]oxepine-10,2-oxiran]-5a-yl)methyl acetate
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CAS No:
Description
15-acetoxyscirpenol, one of acetoxyscirpenol moiety mycotoxins (ASMs), strongly induces apoptosis and inhibits Jurkat T cell growth in a dose-dependent manner by activating other caspases independent of caspase-3[1].
Solid
15-ACETOXY-3ALPHA,4BETA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE Basic Attributes
324.37
324.37
White to off-white
29329990
Characteristics
88.52000
0.55410
1.34±0.1 g/cm3(Predicted)
170-172 °C
465.5±45.0 °C(Predicted)
167.3ºC
1.584
2-8°C
13.72±0.70(Predicted)
2-8°C
15-ACETOXY-3ALPHA,4BETA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE Use and Manufacturing
15-Acetoxyscirpenol is a trichothecene mycotoxin and an apoptosis inducer.
Computed Properties
Molecular Weight:324.4
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:324.15728848
Monoisotopic Mass:324.15728848
Topological Polar Surface Area:88.5
Heavy Atom Count:23
Complexity:588
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation