(2S,3R,6S,9R,10S,18S)-12-ethyl-9-hydroxy-17-methoxy-14-methyl-5-oxa-12-azahexacyclo[8.7.2.12,6.01,11.03,9.014,18]icosane-4,19-dione
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(2S,3R,6S,9R,10S,18S)-12-ethyl-9-hydroxy-17-methoxy-14-methyl-5-oxa-12-azahexacyclo[8.7.2.12,6.01,11.03,9.014,18]icosane-4,19-dione
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CAS No:
52341-40-9
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Formula:
C22H31NO5
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Chemical Name:
(2S,3R,6S,9R,10S,18S)-12-ethyl-9-hydroxy-17-methoxy-14-methyl-5-oxa-12-azahexacyclo[8.7.2.12,6.01,11.03,9.014,18]icosane-4,19-dione
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Synonyms:
DEHYDROHETERATISINE;52341-40-9;DTXSID00315626;NSC295659;NSC-295659
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CAS No:
(2S,3R,6S,9R,10S,18S)-12-ethyl-9-hydroxy-17-methoxy-14-methyl-5-oxa-12-azahexacyclo[8.7.2.12,6.01,11.03,9.014,18]icosane-4,19-dione Basic Attributes
389.5 g/mol
389.22022309 g/mol
295659
DTXSID00315626
Computed Properties
Molecular Weight:389.5
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:389.22022309
Monoisotopic Mass:389.22022309
Topological Polar Surface Area:76.1
Heavy Atom Count:28
Complexity:770
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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