(5S,6S,7S,9R,13Z,15S,16R)-16-Ethyl-6,15-Dihydroxy-15-(Hydroxymethyl)-5,7,9-Trimethyloxacyclohexadeca-3,11,13-Triene-2,10-Dione

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Properties Simple | Detailed

Formula C21H32O6
IUPAC Name (3z,5s,6s,7s,9r,11z,13z,15s,16r)-16-ethyl-6,15-dihydroxy-15-(hydroxymethyl)-5,7,9-trimethyl-1-oxacyclohexadeca-3,11,13-triene-2,10-dione
Molecular Mass 380.475 g·mol−1
Heat of Formation -1108.0 ± 16.7 kJ·mol−1
Dipole Moment 4.63 ± 1.08 D
Volume 481.23 Å 3
Surface Area 345.1 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
Synonyms
  • (3z,5s,6s,7s,9r,11z,13z,15s,16r)-16-ethyl-6,15-dihydroxy-15-(hydroxymethyl)-5,7,9-trimethyl-1-oxacyclohexadeca-3,11,13-triene-2,10-dione
  • (3z,5s,6s,7s,9r,11z,13z,15s,16r)-16-ethyl-6,15-dihydroxy-5,7,9-trimethyl-15-methylol-1-oxacyclohexadeca-3,11,13-triene-2,10-quinone
  • mycinamicin v aglycone
  • mycinolide i, 12,13-deepoxy-12,13-didehydro-14-hydroxy-
  • mycinolide v
CAS Number(s)
  • 77717-05-6
InChIKey GMBJPKQJNVRIQM-SFJONRDKSA-N
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