Methyl (2E,3E,5E,7E,9E)-2-Ethylidene-11-[(1R,4S,5R)-4-Hydroxy-4-(2-Hydroxyethyl)-2-Oxo-6-Oxa-3-Azabicyclo[3.1.0]Hex-1-Yl]-4,6,10-Trimethyl-11-Oxo-3,5,7,9-Undecatetraenoate

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Properties Simple | Detailed

Formula C23H29NO7
IUPAC Name methyl (2e,3e,5e,7e,9e)-2-ethylidene-11-[(1r,4s,5r)-4-hydroxy-4-(2-hydroxyethyl)-2-oxo-6-oxa-3-azabicyclo[3.1.0]hexan-1-yl]-4,6,10-trimethyl-11-oxo-undeca-3,5,7,9-tetraenoate
Molecular Mass 431.479 g·mol−1
Heat of Formation -906.7 ± 16.7 kJ·mol−1
Dipole Moment 7.10 ± 1.08 D
Volume 530.94 Å 3
Surface Area 463.65 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -1.02 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,3e,5e,7e,9e)-2-ethylidene-11-[(1r,2s,5r)-2-hydroxy-2-(2-hydroxyethyl)-4-keto-6-oxa-3-azabicyclo[3.1.0]hexan-5-yl]-11-keto-4,6,10-trimethyl-undeca-3,5,7,9-tetraenoic acid methyl ester
  • (2e,3e,5e,7e,9e)-2-ethylidene-11-[(1r,2s,5r)-2-hydroxy-2-(2-hydroxyethyl)-4-oxo-6-oxa-3-azabicyclo[3.1.0]hexan-5-yl]-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoic acid methyl ester
  • 3,5,7,9-undecatetraenoic acid, 2-ethylidene-11-(4-hydroxy-4-(2-hydroxyethyl)-2-oxo-6-oxa-3-azabicyclo(3.1.0)hex-1-yl)-4,6,10-trimethyl-11-oxo-, methyl ester, (1r-(1-alpha(2e,3e,5e,7e,9e),4-alpha,5-alpha))-
  • fusarin c
  • methyl (2e,3e,5e,7e,9e)-2-ethylidene-11-[(1r,2s,5r)-2-hydroxy-2-(2-hydroxyethyl)-4-oxo-6-oxa-3-azabicyclo[3.1.0]hexan-5-yl]-4,6,10-trimethyl-11-oxo-undeca-3,5,7,9-tetraenoate
  • methyl (2e,3e,5e,7e,9e)-2-ethylidene-11-[(1r,2s,5r)-2-hydroxy-2-(2-hydroxyethyl)-4-oxo-6-oxa-3-azabicyclo[3.1.0]hexan-5-yl]-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoate
CAS Number(s)
  • 79748-81-5
InChIKey FZFYFSUIOSWLHW-UNZVFGKVSA-N
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