(3Z,5E,8R,9E,11Z,14S,16S,17E,19E,24R)-8,14,16-Trihydroxy-24-Methyloxacyclotetracosa-3,5,9,11,17,19-Hexaen-2-One

Molecule SVG Image

Properties Simple | Detailed

Formula C24H34O5
IUPAC Name (3z,5e,8r,9e,11z,14s,16s,17e,19e,24r)-8,14,16-trihydroxy-24-methyl-1-oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one
Molecular Mass 402.524 g·mol−1
Heat of Formation -783.2 ± 16.7 kJ·mol−1
Dipole Moment 3.08 ± 1.08 D
Volume 538.67 Å 3
Surface Area 409.95 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (3z,5e,8r,9e,11z,14s,16s,17e,19e,24r)-8,14,16-trihydroxy-24-methyl-1-oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one
  • macrolactin a
  • macrolactin-a
  • oxacyclotetracosa-3,5,9,11,17,19-hexaen-2-one, 8,14,16-trihydroxy-24-methyl-, (3z,5e,8s,9e,11z,14s,16r,17e,19e,24r)-
CAS Number(s)
  • 122540-27-6
InChIKey XXDIJWSZFWZBRM-QCEWEWFLSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O