(3R,4S,5S,7R,8R,9E,11S,15R,17R)-3,8-Dihydroxy-17-[(S)-Hydroxy{(2S,3R)-2-Methyl-3-[(2S,3Z)-Pent-3-En-2-Yl]Oxiran-2-Yl}Methyl]-4-Methoxy-5,7,9,11,15-Pentamethyloxacyclooctadec-9-Ene-2,6,12,16-Tetrone (Non-Preferred Name)

Molecule SVG Image

Properties Simple | Detailed

Formula C32H50O10
IUPAC Name (3r,4s,5s,7r,8r,9e,11s,15r,17r)-3,8-dihydroxy-17-[(s)-hydroxy-[(2s,3r)-2-methyl-3-[(z,1s)-1-methylbut-2-enyl]oxiran-2-yl]methyl]-4-methoxy-5,7,9,11,15-pentamethyl-1-oxacyclooctadec-9-ene-2,6,12,16-tetrone
Molecular Mass 594.733 g·mol−1
Heat of Formation -1878.2 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 744.7 Å 3
Surface Area 486.39 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 0.40 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s,5s,7r,8r,9e,11s,15r,17r)-3,8-dihydroxy-17-[(s)-hydroxy-[(2s,3r)-2-methyl-3-[(z,1s)-1-methylbut-2-enyl]-2-oxiranyl]methyl]-4-methoxy-5,7,9,11,15-pentamethyl-1-oxacyclooctadec-9-ene-2,6,12,16-tetrone
  • (3r,4s,5s,7r,8r,9e,11s,15r,17r)-3,8-dihydroxy-17-[(s)-hydroxy-[(2s,3r)-2-methyl-3-[(z,1s)-1-methylbut-2-enyl]oxiran-2-yl]methyl]-4-methoxy-5,7,9,11,15-pentamethyl-1-oxacyclooctadec-9-ene-2,6,12,16-diquinone
  • (3r,4s,5s,7r,8r,9e,11s,15r,17r)-3,8-dihydroxy-17-[(s)-hydroxy-[(2s,3r)-2-methyl-3-[(z,1s)-1-methylbut-2-enyl]oxiran-2-yl]methyl]-4-methoxy-5,7,9,11,15-pentamethyl-1-oxacyclooctadec-9-ene-2,6,12,16-tetrone
InChIKey YTOSLGBJMGPGPA-ICYGJJGBSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O