Methyl (3R)-5,10-Dihydroxy-7-Methoxy-3-Methyl-3-(4-Methyl-3-Penten-1-Yl)-3H-Benzo[F]Chromene-9-Carboxylate

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Properties Simple | Detailed

Formula C23H26O6
IUPAC Name methyl (3r)-5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methylpent-3-enyl)benzo[f]chromene-9-carboxylate
Molecular Mass 398.449 g·mol−1
Heat of Formation -914.1 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 470.26 Å 3
Surface Area 404.13 Å 2
HOMO Energy -8.18 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methylpent-3-enyl)-9-benzo[f]chromenecarboxylic acid methyl ester
  • (3r)-5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methylpent-3-enyl)benzo[f]chromene-9-carboxylic acid methyl ester
  • 3h-naphtho[2,1-b]pyran-9-carboxylic acid, 5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methyl-3-pentenyl)-, methyl ester
  • 5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methyl-pent-3-enyl)-3h-benzo[f]chromene-9-carboxylic acid methyl ester
  • methyl (3r)-5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methylpent-3-enyl)benzo[f]chromene-9-carboxylate
  • methyl 5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methylpent-3-en-1-yl)-3h-benzo[f]chromene-9-carboxylate
  • methyl-5,10-dihydroxy-7-methoxy-3-methyl-3-[4-methyl-3-pentenyl]-3h-benzo[f]chromene-9-carboxylate
InChIKey KOZKSXRTQNRWGJ-HSZRJFAPSA-N
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