| SpectraBase Compound ID | 6hF9bUFZrNF |
|---|---|
| InChI | InChI=1S/C48H84O9/c1-10-11-12-13-14-15-16-17-18-21-38(52)56-42-34(30-49)55-43(41(54)40(42)53)57-48(9,25-19-20-31(2)3)32-22-27-47(8)39(32)33(50)29-36-45(6)26-24-37(51)44(4,5)35(45)23-28-46(36,47)7/h20,32-37,39-43,49-51,53-54H,10-19,21-30H2,1-9H3/t32-,33+,34+,35-,36+,37-,39+,40+,41+,42+,43-,45-,46+,47+,48-/m0/s1 |
| InChIKey | ZVULUHDJOPLZHP-MRTHMWHJSA-N |
| Mol Weight | 805.2 g/mol |
| Molecular Formula | C48H84O9 |
| Exact Mass | 804.611534 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AaQXV3Qbok9 |
|---|---|
| Name | 3-BETA,12-BETA,(20S)-TRIHYDROXY-DAMMAR-24-ENE-20-O-BETA-D-GLUCOPYRANOSYL-4'-LAUROYLESTER |
| Compound Number | 2B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H84O9 |
| InChI | InChI=1S/C48H84O9/c1-10-11-12-13-14-15-16-17-18-21-38(52)56-42-34(30-49)55-43(41(54)40(42)53)57-48(9,25-19-20-31(2)3)32-22-27-47(8)39(32)33(50)29-36-45(6)26-24-37(51)44(4,5)35(45)23-28-46(36,47)7/h20,32-37,39-43,49-51,53-54H,10-19,21-30H2,1-9H3/t32-,33+,34+,35-,36+,37-,39+,40+,41+,42+,43-,45-,46+,47+,48-/m0/s1 |
| InChIKey | ZVULUHDJOPLZHP-MRTHMWHJSA-N |
| Literature Reference Author | W.F.LI,L.R.CHEN,X.J.GONG,Z.N.LI,K.K.LI |
| Literature Reference Citation | MOLECULES,18,3689(2013) |
| Literature Reference DOI | 10.3390/molecules18043689 |
| Molecular Weight | 805.190 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT9103 |