(1β,11Alpha,12Alpha,15β)-1,11,12-Trihydroxy-2,16-Dioxo-11,20-Epoxypicrasa-3,13(21)-Dien-15-Yl (2E)-3-Methyl-2-Octenoate
Properties
Property | Value |
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Formula | C29H38O9 |
IUPAC Name | (1beta,11alpha,12alpha,15beta)-1,11,12-trihydroxy-2,16-dioxo-11,20-epoxypicrasa-3,13(21)-dien-15-yl (2e)-3-methyl-2-octenoate |
Molecular Mass | 530.607 g·mol−1 |
Heat of Formation | -1556.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.74 ± 1.08 D |
Volume | 622.35 Å 3 |
Surface Area | 483.28 Å 2 |
HOMO Energy | -9.36 ± 0.55 eV |
LUMO Energy | 2.68 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | XOCICDFNNMOAKJ-OLGFVZGESA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |