Stephamiersine structure

Stephamiersine

3,4,11,12-tetramethoxy-17-methyl-18-oxa-17-azapentacyclo[8.4.3.18,11.01,10.02,7]octadeca-2(7),3,5-trien-13-one

Also Known As: Stephamiersine|Epistephamiersine|NP0374|(7S)-8,10-Epoxy-3,4,7,8-tetramethoxy-17-methylhasubanan-6-one|(1S,8S,10S,11R,12S)-3,4,11,12-tetramethoxy-17-methyl-18-oxa-17-azapentacyclo[8.4.3.18,11.01,10.02,7]octadeca-2(7),3,5-trien-13-one|(7S)-8beta,10beta-Epoxy-3,4,7,8-tetramethoxy-17-methylhasubanan-6-one|(7beta,8beta,10beta)-3,4,7,8-Tetramethoxy-17-methyl-8,10-epoxyhasubanan-6- one|(1S,8S,10S,11R,12R)-3,4,11,12-tetramethoxy-17-methyl-18-oxa-17-azapentacyclo(8.4.3.18,11.01,10.02,7)octadeca-2(7),3,5-trien-13-one|(1S,8S,10S,11R,12R)-3,4,11,12-tetramethoxy-17-methyl-18-oxa-17-azapentacyclo[8.4.3.18,11.01,10.02,7]octadeca-2(7),3,5-trien-13-one

CAS: 52309-76-9
Molecular Formula C21H27NO6
Molecular Weight 389.18384 g/mol
LogP 0.8
Topological Polar Surface Area 66.5 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 389.18384
Monoisotopic Mass 389.18384
Heavy Atoms 28
Complexity 673.0

Chemical Identifiers

CAS Number 52309-76-9
SMILES CN1CCC23C14CC(C5=C2C(=C(C=C5)OC)OC)OC4(C(C(=O)C3)OC)OC
InChIKey UTTZNWQGZHNUIG-UHFFFAOYSA-N

Product Overview

Stephamiersine (CAS 52309-76-9), with molecular formula C21H27NO6 and molecular weight 389.18384 g/mol. IUPAC: 3,4,11,12-tetramethoxy-17-methyl-18-oxa-17-azapentacyclo[8.4.3.18,11.01,10.02,7]octadeca-2(7),3,5-trien-13-one.

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