(1Ar,1Bs,3Ar,3Br,4R,4As,5Ar,5Bs,9R,9As)-9-[(2R)-1,2-Dihydroxy-2-Propanyl]-4-Hydroxy-3A,5B-Dimethyl-1A,1B,3A,3B,4,4A,5A,5B-Octahydro-3H,7H-Oxireno[5,6][2]Benzofuro[7,1-Fg]Oxireno[I]Isochromene-3,7-Dione
Properties
Property | Value |
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Formula | C19H22O9 |
IUPAC Name | (1ar,1bs,3ar,3br,4r,4as,5ar,5bs,9r,9as)-9-[(2r)-1,2-dihydroxy-2-propanyl]-4-hydroxy-3a,5b-dimethyl-1a,1b,3a,3b,4,4a,5a,5b-octahydro-3h,7h-oxireno[5,6][2]benzofuro[7,1-fg]oxireno[i]isochromene-3,7-dione |
Molecular Mass | 394.373 g·mol−1 |
Heat of Formation | -1267.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.97 ± 1.08 D |
Volume | 418.79 Å 3 |
Surface Area | 329.14 Å 2 |
HOMO Energy | -10.63 ± 0.55 eV |
LUMO Energy | -0.85 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | LCHSSOYHOCFOEO-AXEBLSJMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |