(6R,7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,6,15,17,27,29-Hexahydroxy-11-Methoxy-3,7,12,14,16,18,22-Heptamethyl-23-Oxo-8,30-Dioxa-24-Azatetracyclo[23.3.1.1~4,7~.0~5,28~]Triaconta-1(29),2,4,9, 19,21,25,27-Octaen-13-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C37H49NO12 |
IUPAC Name | (6r,7s,9e,11s,12r,13s,14r,15r,16r,17s,18s,19e,21z)-2,6,15,17,27,29-hexahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-23-oxo-8,30-dioxa-24-azatetracyclo[23.3.1.1 4,7 .0 5,28 ]triaconta-1(29),2,4,9, 19,21,25,27-octaen-13-yl acetate |
Molecular Mass | 699.784 g·mol−1 |
Heat of Formation | -2153.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.54 ± 1.08 D |
Volume | 808.33 Å 3 |
Surface Area | 553.53 Å 2 |
HOMO Energy | -8.07 ± 0.55 eV |
LUMO Energy | -0.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | OUOULRWGQDSKTQ-ZVFQNIRDSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |