Methyl (2E)-4-{[(5α,6Beta)-3,14-Dihydroxy-17-Methyl-4,5-Epoxymorphinan-6-Yl]Amino}-4-Oxo-2-Butenoate

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Formula C22H26N2O6
IUPAC Name methyl (e)-4-[[(3r,4r,4as,7r,7ar,12bs)-4a,9-dihydroxy-3-methyl-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl]amino]-4-oxo-but-2-enoate
Molecular Mass 414.452 g·mol−1
Heat of Formation -859.3 ± 16.7 kJ·mol−1
Dipole Moment 2.61 ± 1.08 D
Volume 472.09 Å 3
Surface Area 389.28 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
InChIKey VYGVQURMYFVOPO-IRYZUVSXSA-N
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