(20β)-16,17-Didehydrocorynan-5β,16-dicarboxylic acid 16-methyl ester
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(20β)-16,17-Didehydrocorynan-5β,16-dicarboxylic acid 16-methyl ester
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CAS No:
58514-04-8
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Formula:
C22H26N2O4
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Chemical Name:
(20β)-16,17-Didehydrocorynan-5β,16-dicarboxylic acid 16-methyl ester
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Synonyms:
(20β)-16,17-Didehydrocorynan-5β,16-dicarboxylic acid 16-methyl ester;Anhydroadirubine
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CAS No:
(20β)-16,17-Didehydrocorynan-5β,16-dicarboxylic acid 16-methyl ester Basic Attributes
382.45284
382.189
Computed Properties
Molecular Weight:382.5
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:382.18925731
Monoisotopic Mass:382.18925731
Topological Polar Surface Area:82.6
Heavy Atom Count:28
Complexity:650
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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