Sipholenol A
Properties
Property | Value |
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Formula | C30H52O4 |
IUPAC Name | (3r,5ar,6r,7s,9ar)-6-[2-[(1r,3ar,5s,8ar)-1-hydroxy-1,4,4,6-tetramethyl-2,3,3a,5,8,8a-hexahydroazulen-5-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3h-benzo[b]oxepine-3,7-diol |
Molecular Mass | 476.731 g·mol−1 |
Heat of Formation | -1073.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.29 ± 1.08 D |
Volume | 637.09 Å 3 |
Surface Area | 455.85 Å 2 |
HOMO Energy | -9.07 ± 0.55 eV |
LUMO Energy | 4.42 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | LVWWPNAIMBYRKG-KOHQYJKCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |