[(1S,2R,13R,14S,17S,18S)-18-methyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl] acetate
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[(1S,2R,13R,14S,17S,18S)-18-methyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl] acetate
structure -
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CAS No:
5976-39-6
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Formula:
C21H27NO3
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Chemical Name:
[(1S,2R,13R,14S,17S,18S)-18-methyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl] acetate
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Synonyms:
NSC79602;NSC-79602;5976-39-6;3,2-(1-Oxa-2-aza-2-propene-1,3-diyl)estra-2,4-diene-17beta-ol acetate
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CAS No:
[(1S,2R,13R,14S,17S,18S)-18-methyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl] acetate Basic Attributes
341.4 g/mol
341.19909372 g/mol
79602
Computed Properties
Molecular Weight:341.4
XLogP3:3.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:341.19909372
Monoisotopic Mass:341.19909372
Topological Polar Surface Area:52.3
Heavy Atom Count:25
Complexity:602
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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