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Home > Encyclopedia > [(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate

[(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate

[(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate structure

[(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate 

structure
  • CAS No:

    122297-37-4

  • Formula:

    C24H34O6

  • Chemical Name:

    [(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate

  • Synonyms:

    Paniculadiol diacetate;122297-37-4;DTXSID80153563;2(5H)-Furanone, 4-(2-(4a,5-bis((acetyloxy)methyl)-1,2,3,4,4a,7,8,8a-octahydro-1,2-dimethyl-1-naphthalenyl)ethyl)-, (1S-(1alpha,2beta,4abeta,8aalpha))-

[(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate Basic Attributes

418.5 g/mol

418.23553880 g/mol

DTXSID80153563

Characteristics

78.9 Ų

Computed Properties

Molecular Weight:418.5
XLogP3:3.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:418.23553880
Monoisotopic Mass:418.23553880
Topological Polar Surface Area:78.9
Heavy Atom Count:30
Complexity:766
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(4aS,5R,6S,8aR)-8a-(acetyloxymethyl)-5,6-dimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl acetate

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