(2S,3S,4As,10Br)-2,3,7-Trihydroxy-9-Methoxy-4A-Methyl-1,2,3,4,4A,10B-Hexahydro-6H-Benzo[C]Chromen-6-One

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Properties Simple | Detailed

Formula C15H18O6
IUPAC Name (2s,3s,4as,10br)-2,3,7-trihydroxy-9-methoxy-4a-methyl-2,3,4,10b-tetrahydro-1h-benzo[c]chromen-6-one
Molecular Mass 294.300 g·mol−1
Heat of Formation -1078.1 ± 16.7 kJ·mol−1
Dipole Moment 3.75 ± 1.08 D
Volume 328.12 Å 3
Surface Area 285.2 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4as,10br)-2,3,7-trihydroxy-9-methoxy-4a-methyl-2,3,4,10b-tetrahydro-1h-benzo[c]isochromen-6-one
  • dihydroaltenuenes b
InChIKey HDWRQDAKGPKDFF-YOLKCXPHSA-N
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Elements H C O