6-(3-Furyl)-13-hydroxy-5,12,16,16-tetramethyl-7,10,17-trioxahexacyclo[13.3.3.01,15 02,12 05,11 09,11]henicos-19-ene-8,14,21-trione
7688
Reference
6-(3-Furyl)-13-hydroxy-5,12,16,16-tetramethyl-7,10,17-trioxahexacyclo[13.3.3.01,15 02,12 05,11 09,11]henicos-19-ene-8,14,21-trione Structure
Systematic / IUPAC Name: 6-(3-Furyl)-13-hydroxy-5,12,16,16-tetramethyl-7,10,17-trioxahexacyclo[13.3.3.01,15 02,12 05,11 09,11]henicos-19-ene-8,14,21-trione
ID: Reference7688
Other Names: 1H,3H-11b,3a-[1]Propenofuro[3',4':5,6]naphth[2,1-c]oxireno[d]pyran-4,7,14(5H,6aH)-trione, 9-(3-furanyl)-5a,9,9a,10,11,11a-hexahydro-5-hydroxy-3,3,5a,9a-tetramethyl-
Formula: C26H28O8
Spectral Data
6-(3-Furyl)-13-hydroxy-5,12,16,16-tetramethyl-7,10,17-trioxahexacyclo[13.3.3.01,15 02,12 05,11 09,11]henicos-19-ene-8,14,21-trione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
| No. of Spectral Trees | 1 |
| No. of Spectra | 162 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/4/2018 8:19:23 AM |
Identificators
| InChI | InChI=1S/C26H28O8/c1-21(2)25-15(27)6-9-24(25,12-32-21)14-5-8-22(3)18(13-7-10-31-11-13)33-20(30)19-26(22,34-19)23(14,4)16(28)17(25)29/h6-7,9-11,14,16,18-19,28H,5,8,12H2,1-4H3 |
| InChI Key | IUXAGRKMQRVAMG-UHFFFAOYSA-N |
| Canonical SMILES | CC1(C23C(=O)C=CC2(CO1)C4CCC5(C(OC(=O)C6C5(C4(C(C3=O)O)C)O6)C7=COC=C7)C)C |
| CAS | |
| Splash | |
| Other Names | 1H,3H-11b,3a-[1]Propenofuro[3',4':5,6]naphth[2,1-c]oxireno[d]pyran-4,7,14(5H,6aH)-trione, 9-(3-furanyl)-5a,9,9a,10,11,11a-hexahydro-5-hydroxy-3,3,5a,9a-tetramethyl- |