Stellettin M

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Properties Simple | Detailed

Formula C30H42O4
IUPAC Name (2e,4e,6e,8e,10z)-10-[(3as,5ar,7s,9ar,9bs)-7-hydroxy-3a,6,6,9a-tetramethyl-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-3-ylidene]-2,6-dimethyl-undeca-2,4,6,8-tetraenoic acid
Molecular Mass 466.652 g·mol−1
Heat of Formation -698.8 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 610.57 Å 3
Surface Area 492.97 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e,6e,8e,10z)-10-[(3as,5ar,7s,9ar,9bs)-7-hydroxy-2-keto-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e]inden-3-ylidene]-2,6-dimethyl-undeca-2,4,6,8-tetraenoic acid
  • (2e,4e,6e,8e,10z)-10-[(3as,5ar,7s,9ar,9bs)-7-hydroxy-3a,6,6,9a-tetramethyl-2-oxo-1,4,5,5a,7,8,9,9b-octahydrobenzo[e]inden-3-ylidene]-2,6-dimethyl-undeca-2,4,6,8-tetraenoic acid
InChIKey HQKNXSLBDXDYEF-BPBRLBPSSA-N
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