(1E,4S,5Z,7R,9E,11Ar,14S,14Ar,15S,15Ar,16As,16Br)-15-Ethyl-7-Hydroxy-14-[(1S)-1-(1H-Indol-3-Yl)Ethyl]-4,6,15A-Trimethyl-4,7,14,14A,15,15A,16A,16B-Octahydro-3H-Cyclotrideca[D]Oxireno[F]Isoindole-8,11,12(13H)-Trione

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Formula C34H40N2O5
IUPAC Name (1e,4s,5z,7r,9e,11ar,14s,14ar,15s,15ar,16as,16br)-15-ethyl-7-hydroxy-14-[(1s)-1-(1h-indol-3-yl)ethyl]-4,6,15a-trimethyl-4,7,14,14a,15,15a,16a,16b-octahydro-3h-cyclotrideca[d]oxireno[f]isoindole-8,11,12(13h)-trione
Molecular Mass 556.692 g·mol−1
Heat of Formation -554.6 ± 16.7 kJ·mol−1
Dipole Moment 6.63 ± 1.08 D
Volume 684.9 Å 3
Surface Area 499.71 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
Synonyms
  • 10,11-dinor(13)cytochalasa-13,17,21-triene-1,20,23-trione, 6,7-epoxy-5-ethyl-19-hydroxy-3-(1-(1h-indol-3-yl)ethyl)-16,18-dimethyl-, (3s(r),5s,7s,13e,16s,17e,19r,21e)-
InChIKey RSYKJHLWNMXRKZ-RVUXUPINSA-N
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