(1E,4S,6R,6As,7As,8S,8Ar,11S,11Ar,12S,12Ar,13As,13Br)-11-Benzyl-6-Hydroxy-4,6,12,12A-Tetramethyl-5,9-Dioxo-4,5,6,6A,7A,8,9,10,11,11A,12,12A,13A,13B-Tetradecahydro-3H-Oxireno[9,10]Cycloundeca[1,2-D]Oxireno[F]Isoindol-8-Yl Acetate

Molecule SVG Image

Properties Simple | Detailed

Formula C30H37NO7
IUPAC Name (1e,4s,6r,6as,7as,8s,8ar,11s,11ar,12s,12ar,13as,13br)-11-benzyl-6-hydroxy-4,6,12,12a-tetramethyl-5,9-dioxo-4,5,6,6a,7a,8,9,10,11,11a,12,12a,13a,13b-tetradecahydro-3h-oxireno[9,10]cycloundeca[1,2-d]oxireno[f]isoindol-8-yl acetate
Molecular Mass 523.617 g·mol−1
Heat of Formation -996.2 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 615.85 Å 3
Surface Area 443.64 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 3.00 ± eV
Point Group Symmetry C1
Synonyms
  • 19,20-epoxycytochalasin q
  • 3h-oxireno[f]oxireno[9,10]cycloundec[1,2-d]isoindole-5,9(4h,10h)-dione, 8-(acetyloxy)-6,6a,7a,8,11,11a,12,12a,13a,13b-decahydro-6-hydroxy-4,6,12,12a-tetramethyl-11-(phenylmethyl)-, (1e,4s,6r,6as,7as,8s,8ar,11s,11ar,12s,12ar,13as,13br)-
InChIKey GSPOYKSHFNFUKI-QAWWVLLQSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N