![8-Benzyloxy-12a-methyloctahydropyrano[4,3-a]phenanthrene-3spiro-2'-(4'-benzyloxy-5'-ethoxycarbonyldihydropyran)](/api/spectrum/4srgrn7c6eR/structure.png?h=300&w=458 "8-Benzyloxy-12a-methyloctahydropyrano[4,3-a]phenanthrene-3spiro-2'-(4'-benzyloxy-5'-ethoxycarbonyldihydropyran)")
| SpectraBase Compound ID | CE8yYsb8lFL |
|---|---|
| InChI | InChI=1S/C39H42O7/c1-3-42-37(41)33-24-44-39(22-35(33)46-36(40)27-12-8-5-9-13-27)21-34-32-16-14-28-20-29(43-23-26-10-6-4-7-11-26)15-17-30(28)31(32)18-19-38(34,2)25-45-39/h4-13,15,17,20,24,31-32,34-35H,3,14,16,18-19,21-23,25H2,1-2H3/t31-,32+,34+,35+,38+,39?/m0/s1 |
| InChIKey | ZOEAURWLOUJSBG-JXIPATFOSA-N |
| Mol Weight | 622.8 g/mol |
| Molecular Formula | C39H42O7 |
| Exact Mass | 622.293054 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4srgrn7c6eR |
|---|---|
| Name | 8-Benzyloxy-12a-methyloctahydropyrano[4,3-a]phenanthrene-3spiro-2'-(4'-benzyloxy-5'-ethoxycarbonyldihydropyran) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C39H42O7 |
| InChI | InChI=1S/C39H42O7/c1-3-42-37(41)33-24-44-39(22-35(33)46-36(40)27-12-8-5-9-13-27)21-34-32-16-14-28-20-29(43-23-26-10-6-4-7-11-26)15-17-30(28)31(32)18-19-38(34,2)25-45-39/h4-13,15,17,20,24,31-32,34-35H,3,14,16,18-19,21-23,25H2,1-2H3/t31-,32+,34+,35+,38+,39?/m0/s1 |
| InChIKey | ZOEAURWLOUJSBG-JXIPATFOSA-N |
| Molecular Weight | 622.758 g/mol |
| SMILES | C=1([C@@](CC2(OC1)OC[C@@]1([C@@]([C@]3([C@@](c4ccc(cc4CC3)OCc3ccccc3)([H])CC1)[H])(C2)[H])C)(OC(=O)c1ccccc1)[H])C(=O)OCC |
| SPLASH | splash10-0006-9001030000-0e74ec47e731751da203 |
| Source of Spectrum | QE-6-3758-18 |
| Wiley ID | 845074 |