[5-hydroxy-3,11,11,14-tetramethyl-15-oxo-4,6-di(propanoyloxy)-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl propanoate
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[5-hydroxy-3,11,11,14-tetramethyl-15-oxo-4,6-di(propanoyloxy)-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl propanoate
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CAS No:
81943-57-9
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Formula:
C29H40O8
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Chemical Name:
[5-hydroxy-3,11,11,14-tetramethyl-15-oxo-4,6-di(propanoyloxy)-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl propanoate
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Synonyms:
81943-57-9;3,5,20-Tri-O-propionylingenol;DTXSID501002327;1H-2,8a-Methanocyclopenta(a)cyclopropa(e)cyclodecen-11-one, 1a,2,5,5a,6,9,10,10a-octahydro-5a-hydroxy-1,1,7,9-tetramethyl-5,6-bis(1-oxopropoxy)-4-((1-oxopropoxy)methyl)-, (1aR-(1aalpha,2beta,5beta,5abeta,6beta,8aalpha,9alpha,10a.alpha))-;5a-Hydroxy-1,1,7,9-tetramethyl-11-oxo-4-[(propanoyloxy)methyl]-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-5,6-diyl dipropanoate
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CAS No:
[5-hydroxy-3,11,11,14-tetramethyl-15-oxo-4,6-di(propanoyloxy)-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl propanoate Basic Attributes
516.6 g/mol
516.27231823 g/mol
Computed Properties
Molecular Weight:516.6
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:516.27231823
Monoisotopic Mass:516.27231823
Topological Polar Surface Area:116
Heavy Atom Count:37
Complexity:1070
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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