Phlegmanol C
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Phlegmanol C
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CAS No:
1260-05-5
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Formula:
C32H52O3
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Chemical Name:
Phlegmanol C
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Synonyms:
1H-Cyclohepta[1,2-a:5,4-a′]dinaphthalene-3,11-diol,2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-eicosahydro-4,4,6a,10,10,13a,15b-heptamethyl-,3-acetate,(3S,4aR,6aS,9aR,11R,13aR,13bS,15aS,15bR)-;C(14a)-Homo-27-norgammacer-14-ene-3,21-diol,3-acetate,(3β,21β)-;21-Episerratenediol,3-acetate;Phlegmanol C;21-epi-Serratenediol 3-acetate;1H-Cyclohepta[1,2-a:5,4-a′]dinaphthalene-3,11-diol,2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-eicosahydro-4,4,6a,10,10,13a,15b-heptamethyl-,3-acetate,[3S-(3α,4aβ,6aα,9aα,11α,13aβ,13bα,15aβ,15bα)]-;21β-Hydroxyserrat-14-en-3β-yl acetate
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CAS No:
Characteristics
46.53000
9.99
1.1±0.1 g/cm3
317-319 °C
543.1±50.0 °C at 760 mmHg
196.5±22.9 °C
1.539
Computed Properties
Molecular Weight:484.8
XLogP3:8.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:484.39164552
Monoisotopic Mass:484.39164552
Topological Polar Surface Area:46.5
Heavy Atom Count:35
Complexity:901
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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