12-Deoxyphorbol 13-tetradecanoate
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12-Deoxyphorbol 13-tetradecanoate
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CAS No:
53414-26-9
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Formula:
C34H54O6
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Chemical Name:
12-Deoxyphorbol 13-tetradecanoate
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Synonyms:
Tetradecanoic acid,(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;Tetradecanoic 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]azulen-9a-yl ester,[1aR-(1aα,1bβ,4aβ,7aα,7bα,8α,9aα)]-;9aH-Cyclopropa[3,4]benz[1,2-e]azulene,tetradecanoic acid deriv.;12-Deoxyphorbol 13-tetradecanoate;12-Deoxyphorbol 13-myristate
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CAS No:
Safety Information
|Danger|H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]|P260, P261, P262, P264, P270, P271, P280, P284, P301+P310, P302+P350, P302+P352, P304+P340, P305+P351+P338, P310, P312, P320, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:558.8
XLogP3:6.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:15
Exact Mass:558.39203944
Monoisotopic Mass:558.39203944
Topological Polar Surface Area:104
Heavy Atom Count:40
Complexity:1010
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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