Ombrabulin

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Properties Simple | Detailed

Formula C21H26N2O6
IUPAC Name (2s)-2-amino-3-hydroxy-n-[2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl]propanamide
Molecular Mass 402.441 g·mol−1
Heat of Formation -794.4 ± 16.7 kJ·mol−1
Dipole Moment 2.69 ± 1.08 D
Volume 478.5 Å 3
Surface Area 350.41 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-hydroxy-n-[2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]propanamide
  • (2s)-2-amino-3-hydroxy-n-[2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl]propanamide
  • (2s)-2-amino-3-hydroxy-n-[2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl]propionamide
InChIKey IXWNTLSTOZFSCM-YVACAVLKSA-N
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