[(9S,10S,11R,17S)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6-trien-10-yl]methyl acetate
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[(9S,10S,11R,17S)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6-trien-10-yl]methyl acetate
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CAS No:
18397-05-2
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Formula:
C23H28N2O3
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Chemical Name:
[(9S,10S,11R,17S)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6-trien-10-yl]methyl acetate
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Synonyms:
18397-05-2;O-Acetylretuline;DTXSID90939779;1-Acetylcur-19-en-17-yl acetate;Curan-17-ol, 1-acetyl-19,20-didehydro-, acetate (ester), (16a,19E)-
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CAS No:
[(9S,10S,11R,17S)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6-trien-10-yl]methyl acetate Basic Attributes
380.5 g/mol
380.20999276 g/mol
Computed Properties
Molecular Weight:380.5
XLogP3:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:380.20999276
Monoisotopic Mass:380.20999276
Topological Polar Surface Area:49.8
Heavy Atom Count:28
Complexity:719
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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