(12-hydroxy-4,8,12-trimethyl-16-methylidene-15-oxo-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl) acetate
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(12-hydroxy-4,8,12-trimethyl-16-methylidene-15-oxo-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl) acetate
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CAS No:
28028-68-4
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Formula:
C22H32O5
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Chemical Name:
(12-hydroxy-4,8,12-trimethyl-16-methylidene-15-oxo-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl) acetate
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Synonyms:
crassin acetate;Crassin acetate;MLS002607976;CHEMBL1980797;NCI60_003355;NCI60_004104;SMR001526734
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CAS No:
(12-hydroxy-4,8,12-trimethyl-16-methylidene-15-oxo-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl) acetate Basic Attributes
376.5 g/mol
376.22497412 g/mol
46728|36437
Computed Properties
Molecular Weight:376.5
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:376.22497412
Monoisotopic Mass:376.22497412
Topological Polar Surface Area:72.8
Heavy Atom Count:27
Complexity:660
Undefined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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