(14E,16S,17S)-8-{Methyl[2-(2-pyridinyl)ethyl]amino}-17-[2-(4-morpholinyl)-2-oxoethyl]-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6,8,10,14-tetraen-2-one

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Systematic / IUPAC Name: (14E,16S,17S)-8-[Methyl(2-pyridin-2-ylethyl)amino]-17-(2-morpholin-4-yl-2-oxoethyl)-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6(11),7,9,14-tetraen-2-one

ID: Reference10122

Other Names: 2H-5,9-Methano-1,9,12-benzoxadiazacyclopentadecin-10(11H)-one, 5,6,7,8,12,13-hexahydro-15-[methyl[2-(2-pyridinyl)ethyl]amino]-6-[2-(4-morpholinyl)-2-oxoethyl]-, (3E,5S,6S)-;
MC14-529788

Formula: C31H41N5O4

Spectral Data

(14E,16S,17S)-8-{Methyl[2-(2-pyridinyl)ethyl]amino}-17-[2-(4-morpholinyl)-2-oxoethyl]-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6,8,10,14-tetraen-2-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 189
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 12/3/2020 2:01:26 PM
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Identificators

InChI InChI=1S/C31H41N5O4/c1-34(12-10-27-6-2-3-11-33-27)28-7-8-29-26(19-28)21-32-22-31(38)36-13-9-24(25(23-36)5-4-16-40-29)20-30(37)35-14-17-39-18-15-35/h2-8,11,19,24-25,32H,9-10,12-18,20-23H2,1H3/b5-4+/t24-,25-/m0/s1
InChI Key JIWJSXSOFSQOSE-AXJLXYLLSA-N
Canonical SMILES CN(CCC1=CC=CC=N1)C2=CC3=C(C=C2)OCC=CC4CN(CCC4CC(=O)N5CCOCC5)C(=O)CNC3
CAS
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Other Names 2H-5,9-Methano-1,9,12-benzoxadiazacyclopentadecin-10(11H)-one, 5,6,7,8,12,13-hexahydro-15-[methyl[2-(2-pyridinyl)ethyl]amino]-6-[2-(4-morpholinyl)-2-oxoethyl]-, (3E,5S,6S)-;
MC14-529788

In Other Databases

PubChem 71694374
ChemSpider 72446046