(+)-Crocacin C

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Properties Simple | Detailed

Formula C22H31NO3
IUPAC Name (2e,4e,6s,7s,8r,9s,10e)-7,9-dimethoxy-3,6,8-trimethyl-11-phenyl-undeca-2,4,10-trienamide
Molecular Mass 357.486 g·mol−1
Heat of Formation -401.2 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 480.87 Å 3
Surface Area 408.37 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.29 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e,10e)(6s,7s,9s,8r)-7,9-dimethoxy-3,6,8-trimethyl-11-phenylundeca-2,4,10-trienamide
  • crocacin c
InChIKey JCMQQWWEDGWMJB-ZAFMVVCLSA-N
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