Methyl 5-acetoxy-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxohexadecahydro-2H-naphtho[1,2-H]isochromene-2-carboxylate
7558
Reference
Methyl 5-acetoxy-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxohexadecahydro-2H-naphtho[1,2-H]isochromene-2-carboxylate Structure
Systematic / IUPAC Name: Methyl 5-acetoxy-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxohexadecahydro-2H-naphtho[1,2-H]isochromene-2-carboxylate
ID: Reference7558
Other Names: 2H-Phenanthro[1,2-c]pyran-2-carboxylic acid, 5-(acetyloxy)hexadecahydro-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxo-, methyl ester
Formula: C28H38O10
Spectral Data
Methyl 5-acetoxy-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxohexadecahydro-2H-naphtho[1,2-H]isochromene-2-carboxylate 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 |
| No. of Spectral Trees | 1 |
| No. of Spectra | 162 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/16/2018 7:51:38 AM |
Identificators
| InChI | InChI=1S/C28H38O10/c1-12-10-14-26(6)16(31)11-15(30)24(3,4)18(26)17(32)20(37-13(2)29)27(14,7)19-21(33)38-28(8,23(35)36-9)22(34)25(12,19)5/h14,16-20,31-32H,1,10-11H2,2-9H3 |
| InChI Key | BTGVTHAIJREEMO-UHFFFAOYSA-N |
| Canonical SMILES | CC(=O)OC1C(C2C(C(=O)CC(C2(C3C1(C4C(=O)OC(C(=O)C4(C(=C)C3)C)(C)C(=O)OC)C)C)O)(C)C)O |
| CAS | |
| Splash | |
| Other Names | 2H-Phenanthro[1,2-c]pyran-2-carboxylic acid, 5-(acetyloxy)hexadecahydro-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylene-1,4,8-trioxo-, methyl ester |