| Formula |
C20H28O4 |
| IUPAC Name |
(1r,4s,8s,9r,10r,12r)-9-[2-(3-furyl)ethyl]-9-hydroxy-4,8,10-trimethyl-2-oxatricyclo[6.3.1.04,12]dodecan-3-one |
| Molecular Mass |
332.434 g·mol−1 |
| Heat of Formation |
-722.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.31 ± 1.08 D |
| Volume |
407.68 Å 3 |
| Surface Area |
327.05 Å 2 |
| HOMO Energy |
-9.34 ± 0.55 eV |
| LUMO Energy |
0.51 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2h-naphtho(1,8-bc)furan-2-one, 6-(2-(3-furanyl)ethyl)decahydro-6-hydroxy-2a,5a,7-trimethyl-, (2as-(2aalpha,5abeta,6alpha,7alpha,8aalpha,8balpha))-
- marrubiin
|
| CAS Number(s) |
|
| InChIKey |
HQLLRHCTVDVUJB-OBHOOXMTSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
|
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