12-Deoxyphorbol-13-angelate
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12-Deoxyphorbol-13-angelate
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CAS No:
65700-60-9
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Formula:
C25H34O6
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Chemical Name:
12-Deoxyphorbol-13-angelate
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Synonyms:
2-Butenoic acid,2-methyl-,(1aR,1bS,4aR,7aS,7bR,8R,9aS)-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-9aH-cyclopropa[3,4]benz[1,2-e]azulen-9a-yl ester,(2Z)-;2-Butenoic acid,2-methyl-,1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-9aH-cyclopropa[3,4]benz[1,2-e]azulen-9a-yl ester,[1aR-[1aα,1bβ,4aβ,7aα,7bα,8α,9aα(Z)]]-;9aH-Cyclopropa[3,4]benz[1,2-e]azulene,2-butenoic acid deriv.;12-Deoxyphorbol-13-angelate;13-O-Angeloyl-12-Deoxyphorbol
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CAS No:
Computed Properties
Molecular Weight:430.5
XLogP3:1.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:430.23553880
Monoisotopic Mass:430.23553880
Topological Polar Surface Area:104
Heavy Atom Count:31
Complexity:942
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes