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Home > Encyclopedia > aspinolide B

aspinolide B

aspinolide B structure

aspinolide B 

structure
  • CAS No:

    188605-15-4

  • Formula:

    C14H20O6

  • Chemical Name:

    aspinolide B

  • Synonyms:

    aspinolide B;DTXSID401017470;[(2R,3S,4E,6R,7S)-6,7-dihydroxy-2-methyl-10-oxo-2,3,6,7,8,9-hexahydrooxecin-3-yl] (E)-but-2-enoate

  • Categories:

    Organic Chemistry  >  Lactones

aspinolide B Basic Attributes

284.306

284.126

Characteristics

93.1

0.5

Drug Information

aspinolide B

Computed Properties

Molecular Weight:284.30
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:284.12598835
Monoisotopic Mass:284.12598835
Topological Polar Surface Area:93.1
Heavy Atom Count:20
Complexity:401
Defined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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