Methyl (3R)-1-[(5S,6S,8R)-5-Amino-9-(Butylamino)-6-Hydroxy-3,3,8-Trimethyl-9-Oxononanoyl]-1,2,3,4-Tetrahydro-3-Quinolinecarboxylate

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Properties Simple | Detailed

Formula C27H43N3O5
IUPAC Name methyl (3r)-1-[(5s,6s,8r)-5-amino-9-(butylamino)-6-hydroxy-3,3,8-trimethyl-9-oxo-nonanoyl]-3,4-dihydro-2h-quinoline-3-carboxylate
Molecular Mass 489.647 g·mol−1
Heat of Formation -1067.1 ± 16.7 kJ·mol−1
Dipole Moment 6.90 ± 1.08 D
Volume 718.32 Å 3
Surface Area 519.04 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 3.15 ± eV
Point Group Symmetry C1
InChIKey VROPGBJWKDHPPG-WQJYWUQFSA-N
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