Formula |
C27H26O8 |
IUPAC Name |
(1r,2r,3s,3ar,8bs)-1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1h-cyclopenta[b]benzofuran-2-carboxylic acid |
Molecular Mass |
478.491 g·mol−1 |
Heat of Formation |
-1116.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.80 ± 1.08 D |
Volume |
538.85 Å 3 |
Surface Area |
424.18 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
3.13 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (1r,2r,3s,3ar,8bs)-1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1h-cyclopenta[b]benzofuran-2-carboxylic acid
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InChIKey |
HLORMQRMDNZHJH-PXIJUOARSA-N |
QR Code |
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Links |
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Elements |
H
C
O
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