Myxochelin B

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Properties Simple | Detailed

Formula C20H25N3O6
IUPAC Name n-[(5s)-6-amino-5-[(2,3-dihydroxybenzoyl)amino]hexyl]-2,3-dihydroxy-benzamide
Molecular Mass 403.429 g·mol−1
Heat of Formation -971.0 ± 16.7 kJ·mol−1
Dipole Moment 7.26 ± 1.08 D
Volume 479.42 Å 3
Surface Area 357.73 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s)-1-(aminomethyl)-5-[(2,3-dihydroxybenzoyl)amino]pentyl]-2,3-dihydroxy-benzamide
  • n-[(1s)-1-(aminomethyl)-5-[[(2,3-dihydroxyphenyl)-oxomethyl]amino]pentyl]-2,3-dihydroxybenzamide
  • n-[(2s)-1-amino-6-[(2,3-dihydroxybenzoyl)amino]hexan-2-yl]-2,3-dihydroxybenzamide
  • n-[(2s)-1-amino-6-[(2,3-dihydroxyphenyl)carbonylamino]hexan-2-yl]-2,3-dihydroxy-benzamide
InChIKey QTARRKFUMCSVOF-LBPRGKRZSA-N
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