(1S,12R)-12-(16,17-Dimethoxy-1-Methyl-21-Oxo-3,4-Didehydro-19,21-Epoxyaspidospermidin-15-Yl)-7-Hydroxy-15-Methyl-5,15-Diazatetracyclo[10.3.1.0~1,5~.0~6,11~]Hexadeca-6,8,10-Triene-4,16-Dione
Properties
Property | Value |
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Formula | C37H40N4O7 |
IUPAC Name | (1s,12r)-12-(16,17-dimethoxy-1-methyl-21-oxo-3,4-didehydro-19,21-epoxyaspidospermidin-15-yl)-7-hydroxy-15-methyl-5,15-diazatetracyclo[10.3.1.0 1,5 .0 6,11 ]hexadeca-6,8,10-triene-4,16-dione |
Molecular Mass | 652.736 g·mol−1 |
Heat of Formation | -835.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.41 ± 1.08 D |
Volume | 734.36 Å 3 |
Surface Area | 503.95 Å 2 |
HOMO Energy | -8.12 ± 0.55 eV |
LUMO Energy | 0.05 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | SFSFAWRKKRGBKI-ZLEWMSNTSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |