(2S,3As,9Bs)-6-Hydroxy-2-[(1R)-1-Hydroxypropyl]-7,8-Dimethoxy-2,3,3A,9B-Tetrahydro-5H-Furo[3,2-C]Isochromen-5-One
Properties
Property | Value |
---|---|
Formula | C16H20O7 |
IUPAC Name | (2s,3as,9bs)-6-hydroxy-2-[(1r)-1-hydroxypropyl]-7,8-dimethoxy-2,3,3a,9b-tetrahydrofuro[3,2-c]isochromen-5-one |
Molecular Mass | 324.326 g·mol−1 |
Heat of Formation | -1173.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.33 ± 1.08 D |
Volume | 366.6 Å 3 |
Surface Area | 299.36 Å 2 |
HOMO Energy | -9.27 ± 0.55 eV |
LUMO Energy | -0.76 ± eV |
Point Group Symmetry | C1 |
InChIKey | IELGRTIPFVIRGM-DKZXUEBISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |