| SpectraBase Compound ID | 3AKAqRskYVY |
|---|---|
| InChI | InChI=1S/C29H36O11/c1-13(30)38-23-25(2,3)19(18(32)21(33)36-6)27(5)15-7-9-26(4)16(29(15)24(40-29)28(23,35)22(27)34)11-17(31)39-20(26)14-8-10-37-12-14/h8,10,12,15-16,18-20,23-24,32,35H,7,9,11H2,1-6H3/t15-,16-,18+,19+,20+,23+,24-,26-,27-,28+,29-/m1/s1 |
| InChIKey | QBOFNNDGXMMAOI-FXKRGXPTSA-N |
| Mol Weight | 560.6 g/mol |
| Molecular Formula | C29H36O11 |
| Exact Mass | 560.225762 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6X29OAFLTyk |
|---|---|
| Name | METHYL-3-BETA-ACETOXY-2,6-DIHYDROXY-8-ALPHA,30-ALPHA-EPOXY-1-OXO-MELIACATE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O11 |
| InChI | InChI=1S/C29H36O11/c1-13(30)38-23-25(2,3)19(18(32)21(33)36-6)27(5)15-7-9-26(4)16(29(15)24(40-29)28(23,35)22(27)34)11-17(31)39-20(26)14-8-10-37-12-14/h8,10,12,15-16,18-20,23-24,32,35H,7,9,11H2,1-6H3/t15-,16-,18+,19+,20+,23+,24-,26-,27-,28+,29-/m1/s1 |
| InChIKey | QBOFNNDGXMMAOI-FXKRGXPTSA-N |
| Literature Reference Author | K.KOJIMA,K.ISAKA,Y.OGIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,523(1998) |
| Literature Reference DOI | 10.1248/cpb.46.523 |
| Molecular Weight | 560.598 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS6288 |