Milbemycin A3

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Properties Simple | Detailed

Formula C31H44O7
IUPAC Name milbemycin a3
Molecular Mass 528.677 g·mol−1
Heat of Formation -1321.4 ± 16.7 kJ·mol−1
Dipole Moment 4.69 ± 1.08 D
Volume 658.3 Å 3
Surface Area 495.1 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -0.50 ± eV
Point Group Symmetry C1
Synonyms
  • (2ae,4e,5's,6r,6'r,8e,11r,13r,15s,17ar,20r,20ar,20bs)-20,20b-dihydroxy-5',6,6',8,19-pentamethyl-3',4',5',6,6',7,10,11,14,15,17a,20,20a,20b-tetradecahydro-2h,17h-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-17-one
InChIKey ZLBGSRMUSVULIE-GSMJGMFJSA-N
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