Phorbol 12,13-dihexanoate
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Phorbol 12,13-dihexanoate
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CAS No:
37558-17-1
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Formula:
C32H48O8
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Chemical Name:
Phorbol 12,13-dihexanoate
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Synonyms:
Hexanoic acid,1,1′-[(1aR,1bS,4aR,7aS,7bS,8R,9R,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]azulene-9,9a-diyl] ester;Hexanoic acid,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]azulene-9,9a-diyl ester,[1aR-(1aα,1bβ,4aβ,7aα,7bα,8α,9β,9aα)]-;Hexanoic acid,(1aR,1bS,4aR,7aS,7bS,8R,9R,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]azulene-9,9a-diyl ester;9aH-Cyclopropa[3,4]benz[1,2-e]azulene,hexanoic acid deriv.;Phorbol 12,13-dihexanoate
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CAS No:
Computed Properties
Molecular Weight:560.7
XLogP3:4.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:13
Exact Mass:560.33491849
Monoisotopic Mass:560.33491849
Topological Polar Surface Area:130
Heavy Atom Count:40
Complexity:1090
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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