(2R,7S,13R,15R,19S,24R,26R)-10-Chloro-7,13,15,19,26-Pentahydroxy-2-Methoxy-21-Methyl-4,18,23,25-Tetraoxahexacyclo[17.3.2.1~8,12~.1~11,16~.1~16,20~.0~1,24~]Heptacosa-8(27),9,11,20-Tetraene-3,22-Dione
Properties
Property | Value |
---|---|
Formula | C25H27ClO12 |
IUPAC Name | (2r,7s,13r,15r,19s,24r,26r)-10-chloro-7,13,15,19,26-pentahydroxy-2-methoxy-21-methyl-4,18,23,25-tetraoxahexacyclo[17.3.2.1 8,12 .1 11,16 .1 16,20 .0 1,24 ]heptacosa-8(27),9,11,20-tetraene-3,22-dione |
Molecular Mass | 554.928 g·mol−1 |
Heat of Formation | -1828.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.34 ± 1.08 D |
Volume | 568.32 Å 3 |
Surface Area | 401.21 Å 2 |
HOMO Energy | -9.60 ± 0.55 eV |
LUMO Energy | 2.37 ± eV |
Point Group Symmetry | C1 |
InChIKey | VQAOQWPBIWCGNX-FLUHUEHMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Cl |