| SpectraBase Compound ID | 1fdcPPmUqiR |
|---|---|
| InChI | InChI=1S/C41H64O8/c1-23-14-19-41(36(44)45-11)21-20-39(9)28(34(41)24(23)2)12-13-31-38(8)17-16-32(37(6,7)30(38)15-18-40(31,39)10)49-33-22-29(47-26(4)42)35(25(3)46-33)48-27(5)43/h12,23-25,29-35H,13-22H2,1-11H3/t23-,24+,25+,29+,30?,31?,32+,33+,34+,35+,38+,39-,40-,41+/m1/s1 |
| InChIKey | KYLPBKMXPGPPJH-ZLXORITDSA-N |
| Mol Weight | 685.0 g/mol |
| Molecular Formula | C41H64O8 |
| Exact Mass | 684.460119 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4MdVMRGM2la |
|---|---|
| Name | METHYL-3-BETA-O-(3,4-DI-O-ACETYL-2,6-DIDEOXY-ALPHA-L-ARABINO-HEXOPYRANOSYL)-URSOLATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H64O8 |
| InChI | InChI=1S/C41H64O8/c1-23-14-19-41(36(44)45-11)21-20-39(9)28(34(41)24(23)2)12-13-31-38(8)17-16-32(37(6,7)30(38)15-18-40(31,39)10)49-33-22-29(47-26(4)42)35(25(3)46-33)48-27(5)43/h12,23-25,29-35H,13-22H2,1-11H3/t23-,24+,25+,29+,30?,31?,32+,33+,34+,35+,38+,39-,40-,41+/m1/s1 |
| InChIKey | KYLPBKMXPGPPJH-ZLXORITDSA-N |
| Literature Reference Author | O.B.FLEKHTER,L.A.BALTINA,G.A.TOLSTIKOV |
| Literature Reference Citation | J.NAT.PROD.,63,992(2000) |
| Literature Reference DOI | 10.1021/np990273b |
| Molecular Weight | 684.954 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU8595 |