(3S,7S,13S,16Z)-6-(N,N-Dimethyl-L-Isoleucyl-L-Isoleucyl)-19-Methoxy-8,14-Dioxo-2-Oxa-6,9,15-Triazatetracyclo[16.2.2.0~3,7~.0~9,13~]Docosa-1(20),16,18,21-Tetraene

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Formula C33H49N5O6
IUPAC Name (3s,7s,13s,16z)-6-(n,n-dimethyl-l-isoleucyl-l-isoleucyl)-19-methoxy-8,14-dioxo-2-oxa-6,9,15-triazatetracyclo[16.2.2.0 3,7 .0 9,13 ]docosa-1(20),16,18,21-tetraene
Molecular Mass 611.772 g·mol−1
Heat of Formation -1000.4 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 778.2 Å 3
Surface Area 557.95 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey NXCUAFMNFVTKHA-YEEQOOFQSA-N
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