(3β,16E)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic acid methyl ester
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(3β,16E)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic acid methyl ester
structure -
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CAS No:
14509-92-3
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Formula:
C23H30N2O4
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Chemical Name:
(3β,16E)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic acid methyl ester
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Synonyms:
(3β,16E)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic acid methyl ester;Mitraciliatin;Mitraciliatine
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CAS No:
(3β,16E)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic acid methyl ester Basic Attributes
398.4953
398.221
IE9LY4S85X
Computed Properties
Molecular Weight:398.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:398.22055744
Monoisotopic Mass:398.22055744
Topological Polar Surface Area:63.8
Heavy Atom Count:29
Complexity:624
Defined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(3β,16E)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic acid methyl ester
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