3-[(3R,3Ar,10Br)-8-Isopropylidene-3A,10B-Dimethyl-3-{(1S)-1-[(2S)-5-Methyl-6-Oxo-3,6-Dihydro-2H-Pyran-2-Yl]Ethyl}-1,2,3,3A,4,5,8,10B-Octahydrocyclohepta[E]Inden-7-Yl]Propanoic Acid

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Properties Simple | Detailed

Formula C30H40O4
IUPAC Name 3-[(3r,3ar,10br)-3a,10b-dimethyl-8-(1-methylethylidene)-3-[(1s)-1-[(2s)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,3,4,5-tetrahydro-1h-cyclohepta[e]inden-7-yl]propanoate
Molecular Mass 464.636 g·mol−1
Heat of Formation 38.8 ± 16.7 kJ·mol−1
Dipole Moment 2.10 ± 1.08 D
Volume 569.68 Å 3
Surface Area 438.08 Å 2
Point Group Symmetry C1
Synonyms
  • cyclohept(e)indene-7-propanoic acid, 3-((1s)-1-((2s)-3,6-dihydro-5-methyl-6-oxo-2h-pyran-2-yl)ethyl)-1,2,3,3a,4,5,8,10b-octahydro-3a,10b-dimethyl-8-(1-methylethylidene)-, (3r,3ar,10br)-
  • cyclohept[e]indene-7-propanoic acid, 3-[(1s)-1-[(2s)-3,6-dihydro-5-methyl-6-oxo-2h-pyran-2-yl]ethyl]-1,2,3,3a,4,5,8,10b-octahydro-3a,10b-dimethyl-8-(1-methylethylidene)-, (3r,3ar,10br)-
  • lancilactone c
CAS Number(s)
  • 218915-17-4
InChIKey TYAJEEFQBLTASC-NNIFVFKYSA-N
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