| SpectraBase Compound ID | 83RDqzZ0P7W |
|---|---|
| InChI | InChI=1S/C36H58O9/c1-18-10-13-36(31(43)45-30-28(41)27(40)26(39)22(17-37)44-30)15-14-34(6)20(25(36)19(18)2)8-9-24-33(5)16-21(38)29(42)32(3,4)23(33)11-12-35(24,34)7/h8,18-19,21-30,37-42H,9-17H2,1-7H3/t18-,19+,21-,22-,23?,24?,25?,26-,27+,28-,29+,30+,33+,34-,35-,36+/m1/s1 |
| InChIKey | HZKJZYRLLBKBHA-UIPBXBHASA-N |
| Mol Weight | 634.9 g/mol |
| Molecular Formula | C36H58O9 |
| Exact Mass | 634.408083 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ioIbnqRyyO |
|---|---|
| Name | 2-ALPHA,3-BETA-DIHYDROXY-URS-12-EN-28-OIC-ACID-(28->1)-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O9 |
| InChI | InChI=1S/C36H58O9/c1-18-10-13-36(31(43)45-30-28(41)27(40)26(39)22(17-37)44-30)15-14-34(6)20(25(36)19(18)2)8-9-24-33(5)16-21(38)29(42)32(3,4)23(33)11-12-35(24,34)7/h8,18-19,21-30,37-42H,9-17H2,1-7H3/t18-,19+,21-,22-,23?,24?,25?,26-,27+,28-,29+,30+,33+,34-,35-,36+/m1/s1 |
| InChIKey | HZKJZYRLLBKBHA-UIPBXBHASA-N |
| Literature Reference Author | A.R.BILIA,E.PALME,S.CATALANO,G.FLAMINI,I.MORELLI |
| Literature Reference Citation | J.NAT.PROD.,57,333(1994) |
| Literature Reference DOI | 10.1021/np50105a001 |
| Molecular Weight | 634.851 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWTS1769 |