Ganoderic Acid T

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Properties Simple | Detailed

Formula C36H52O8
IUPAC Name [(1s,3r,3ar,6s,7s,9br)-3a,6,9b-trimethyl-7-(1-methylvinyl)-6-[3-(2-oxovinyloxy)propyl]-3-vinyl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-1-yl] acetate; carbon dioxide; penta-2,4-diynyl acetate
Molecular Mass 612.793 g·mol−1
Heat of Formation -1699.0 ± 16.7 kJ·mol−1
Dipole Moment 2.70 ± 1.08 D
Volume 770.48 Å 3
Surface Area 565.48 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy 2.86 ± eV
Point Group Symmetry C1
Synonyms
  • (e,5s,6s)-5-acetoxy-6-[(3r,5r,10s,13r,14r,15s,17r)-3,15-diacetoxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-methyl-hept-2-enoic acid
  • (e,5s,6s)-5-acetoxy-6-[(3r,5r,10s,13r,14r,15s,17r)-3,15-diacetoxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
  • (e,5s,6s)-5-acetyloxy-6-[(3r,5r,10s,13r,14r,15s,17r)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-methyl-hept-2-enoic acid
  • (e,5s,6s)-5-acetyloxy-6-[(3r,5r,10s,13r,14r,15s,17r)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
InChIKey OCLVBEOPEKEKNM-CAXIOAJTSA-N
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