3A,11A-Dihydroxy-13A-(Hydroxymethyl)-9,15A-Dimethyl-1-(5-Oxo-2,5-Dihydro-3-Furanyl)Icosahydro-1H,4'H-Spiro[Cyclopenta[7,8]Phenanthro[2,3-B]Pyrano[3,2-E][1,4]Dioxine-11,2'-[1,3]Thiazolidin]-4'-One
Properties
| Property | Value |
|---|---|
| Formula | C31H43NO9S |
| IUPAC Name | (1r,3as,3br,5as,6ar,7as,9r,11s,11ar,12ar,13ar,13bs,15ar)-3a,11a-dihydroxy-13a-(hydroxymethyl)-9,15a-dimethyl-1-(5-oxo-2,5-dihydro-3-furanyl)icosahydro-1h,4'h-spiro[cyclopenta[7,8]phenanthro[2,3-b]pyrano[3,2-e][1,4]dioxine-11,2'-[1,3]thiazolidin]-4'-one |
| Molecular Mass | 605.739 g·mol−1 |
| Heat of Formation | -1699.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.77 ± 1.08 D |
| Volume | 685.15 Å 3 |
| Surface Area | 510.51 Å 2 |
| HOMO Energy | -9.33 ± 0.55 eV |
| LUMO Energy | 2.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GRINEMOQBRCRRY-WOKMHSITSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |