| SpectraBase Compound ID | 9qd8P3log68 |
|---|---|
| InChI | InChI=1S/C44H72O13/c1-22-31(48)32(49)34(51)38(54-22)57-30-18-29(47)44(9)27(41(30,6)21-53-37-35(52)33(50)36(23(2)55-37)56-24(3)46)12-13-43(8)28(44)11-10-25-26-19-39(4,20-45)14-15-40(26,5)16-17-42(25,43)7/h10,22-23,26-38,45,47-52H,11-21H2,1-9H3/t22-,23-,26-,27?,28?,29-,30-,31-,32+,33-,34+,35+,36-,37+,38-,39+,40+,41-,42+,43+,44+/m0/s1 |
| InChIKey | PECLUJJDDIQHKT-UMDPULCGSA-N |
| Mol Weight | 809.0 g/mol |
| Molecular Formula | C44H72O13 |
| Exact Mass | 808.497292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DluZtCAMd4w |
|---|---|
| Name | 1-ALPHA,3-BETA,23,29-TETRAHYDROXYOLEAN-12-ENE-3-O-ALPHA-L-RHAMNOPYRANOSYL-23-O-ALPHA-L-4-ACETYLRHAMNOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H72O13 |
| InChI | InChI=1S/C44H72O13/c1-22-31(48)32(49)34(51)38(54-22)57-30-18-29(47)44(9)27(41(30,6)21-53-37-35(52)33(50)36(23(2)55-37)56-24(3)46)12-13-43(8)28(44)11-10-25-26-19-39(4,20-45)14-15-40(26,5)16-17-42(25,43)7/h10,22-23,26-38,45,47-52H,11-21H2,1-9H3/t22-,23-,26-,27?,28?,29-,30-,31-,32+,33-,34+,35+,36-,37+,38-,39+,40+,41-,42+,43+,44+/m0/s1 |
| InChIKey | PECLUJJDDIQHKT-UMDPULCGSA-N |
| Literature Reference Author | C.B.ROGERS |
| Literature Reference Citation | J.NAT.PROD.,52,528(1989) |
| Literature Reference DOI | 10.1021/np50063a011 |
| Molecular Weight | 809.048 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWTS1251 |