(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid
Compound with spectra: 1 NMR
![(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid](/api/compound/KEfv8ut1Rzt.png?ph=true&h=300&w=458 "(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid")
| SpectraBase Compound ID | KEfv8ut1Rzt |
|---|---|
| InChI | InChI=1S/C25H38O7/c1-15(26)32-20-16-6-7-18-23(3,9-5-10-24(18,4)21(28)29)17(16)8-11-22(20,2)13-25(30)12-19(27)31-14-25/h16-18,20,30H,5-14H2,1-4H3,(H,28,29)/t16-,17+,18-,20+,22-,23-,24-,25?/m1/s1 |
| InChIKey | BIXPPSSCYPEQID-BFSXEYKHSA-N |
| Mol Weight | 450.6 g/mol |
| Molecular Formula | C25H38O7 |
| Exact Mass | 450.261754 g/mol |
| Enantiomer InChIKey | BIXPPSSCYPEQID-LPFBKHLCSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(5-keto-2H-furan-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid
De-15-methyl-14-acetoxy-15-(2,5-dihydro-furan-2- on-4-yl)-18-isopimaranoic acid
(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(5-keto-2H-furan-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
De-15-methyl-14-acetoxy-15-(2,5-dihydro-furan-2- on-4-yl)-18-isopimaranoic acid, methyl ester
De-15-methyl-18-acetoxy-14,15-(4-acetoxymethyl-4 -hydroxy-1-oxa-2-oxo-butano)-isopimarane
(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(3-acetoxy-2-keto-propyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
14-Acetoxy-16-acetoxymethyl-16-oxo-18-isopimarano ic acid, methyl ester
14-Acetoxy-16-chloromethyl-16-oxo-18-isopimarano ic acid, methyl ester
(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(3-chloro-2-keto-propyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
| Title | Journal or Book | Year |
|---|---|---|
| 13C NMR data for isopimarane and 8-epi-isopimarane diterpenoids | Magnetic Resonance in Chemistry | 1989 |