(8S,9S,12S,13R,14S,16S)-13-Hydroxy-8,14,19-Trimethoxy-4,10,12,16-Tetramethyl-3,20,22-Trioxo-2-Azabicyclo[16.3.1]Docosa-1(21),4,6,10,18-Pentaen-9-Yl Carbamate

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Formula C29H40N2O9
IUPAC Name [(3s,5s,6r,7s,8e,10s,11s,12e,14z)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
Molecular Mass 560.636 g·mol−1
Heat of Formation -1382.7 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 700.11 Å 3
Surface Area 522.48 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy -1.72 ± eV
Point Group Symmetry C1
Synonyms
  • [(3s,5s,6r,7s,8e,10s,11s,12e,14z)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
  • [(3s,5s,6r,7s,8e,10s,11s,12z,14e)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
  • carbamic acid [(3s,5s,6r,7s,8e,10s,11s,12e,14z)-6-hydroxy-16,20,22-triketo-5,11,21-trimethoxy-3,7,9,15-tetramethyl-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
  • carbamic acid [(3s,5s,6r,7s,8e,10s,11s,12e,14z)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
  • carbamic acid [(3s,5s,6r,7s,8e,10s,11s,12z,14e)-6-hydroxy-16,20,22-triketo-5,11,21-trimethoxy-3,7,9,15-tetramethyl-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
  • carbamic acid [(3s,5s,6r,7s,8e,10s,11s,12z,14e)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
  • gmy
InChIKey QTQAWLPCGQOSGP-DEBGGTNISA-N
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