Methyl (1R,3R,4R,14R,18R)-15,19-Dihydroxy-18-(Hydroxymethyl)-14-Methyl-12-Azahexacyclo[10.6.1.1~1,4~.0~7,20~.0~10,18~.0~15,19~]Icosa-7(20),16-Diene-3-Carboxylate

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Formula C23H31NO5
IUPAC Name methyl (1r,3r,4r,10s,14r,15s,18r,19s)-15,19-dihydroxy-18-(hydroxymethyl)-14-methyl-12-azahexacyclo[10.6.1.1 1,4 .0 7,20 .0 10,18 .0 15,19 ]icosa-7(20),16-diene-3-carboxylate
Molecular Mass 401.496 g·mol−1
Heat of Formation -820.6 ± 16.7 kJ·mol−1
Dipole Moment 2.12 ± 1.08 D
Volume 460.92 Å 3
Surface Area 346.51 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy 0.73 ± eV
Point Group Symmetry C1
InChIKey STEHXMPTKMFKML-MXJQEVSQSA-N
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