| SpectraBase Compound ID | yv2UFB65yg |
|---|---|
| InChI | InChI=1S/C36H54O9/c1-19(32(41)42)11-12-26(43-21(3)37)20(2)25-17-29(40)36(10)31-24(13-16-35(25,36)9)34(8)15-14-30(45-23(5)39)33(6,7)28(34)18-27(31)44-22(4)38/h11,20,25-30,40H,12-18H2,1-10H3,(H,41,42)/b19-11+/t20-,25+,26?,27+,28-,29-,30+,34+,35+,36-/m0/s1 |
| InChIKey | GHQBLEWBYHWXAC-ZMNOJDPLSA-N |
| Mol Weight | 630.8 g/mol |
| Molecular Formula | C36H54O9 |
| Exact Mass | 630.376783 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2bFFPm18RXU |
|---|---|
| Name | GANODERIC-ACID-MC;3-ALPHA,7-ALPHA,22-TRIACETOXY-15-ALPHA-HYDROXY-5-ALPHA-LANOST-8,(24E)-DIEN-26-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H54O9 |
| InChI | InChI=1S/C36H54O9/c1-19(32(41)42)11-12-26(43-21(3)37)20(2)25-17-29(40)36(10)31-24(13-16-35(25,36)9)34(8)15-14-30(45-23(5)39)33(6,7)28(34)18-27(31)44-22(4)38/h11,20,25-30,40H,12-18H2,1-10H3,(H,41,42)/b19-11+/t20-,25+,26?,27+,28-,29-,30+,34+,35+,36-/m0/s1 |
| InChIKey | GHQBLEWBYHWXAC-ZMNOJDPLSA-N |
| Literature Reference Author | T.NISHITOBA,H.SATO,S.SHIRASU,S.SAKAMURA |
| Literature Reference Citation | AGR.BIOL.CHEM.,51,619(1987) |
| Literature Reference DOI | 10.1271/bbb1961.51.619 |
| Molecular Weight | 630.819 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT8108 |