| SpectraBase Compound ID | 5vscvR8wGFT |
|---|---|
| InChI | InChI=1S/C36H58O10/c1-18-10-13-36(30(43)46-29-26(41)25(40)24(39)21(17-37)45-29)15-14-33(5)19(27(36)35(18,7)44)8-9-23-32(4)16-20(38)28(42)31(2,3)22(32)11-12-34(23,33)6/h8,18,20-29,37-42,44H,9-17H2,1-7H3/t18-,20-,21-,22+,23-,24+,25+,26-,27-,28+,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | MLKQAGPAYHTNQQ-WMAYGUFESA-N |
| Mol Weight | 650.9 g/mol |
| Molecular Formula | C36H58O10 |
| Exact Mass | 650.402998 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2bFo1MavN7b |
|---|---|
| Name | ROSMUTIN;2-ALPHA,3-ALPHA,19-ALPHA-TRIHYDROXY-URS-12-EN-28-OIC-ACID-BETA-D-GALACTOPYRANOSYLESTER |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O10 |
| InChI | InChI=1S/C36H58O10/c1-18-10-13-36(30(43)46-29-26(41)25(40)24(39)21(17-37)45-29)15-14-33(5)19(27(36)35(18,7)44)8-9-23-32(4)16-20(38)28(42)31(2,3)22(32)11-12-34(23,33)6/h8,18,20-29,37-42,44H,9-17H2,1-7H3/t18-,20-,21-,22+,23-,24+,25+,26-,27-,28+,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | MLKQAGPAYHTNQQ-WMAYGUFESA-N |
| Literature Reference Author | Z.J.JIA,X.Q.LIU,Z.M.LIU |
| Literature Reference Citation | PHYTOCHEM.,32,155(1993) |
| Literature Reference DOI | 10.1016/0031-9422(92)80123-V |
| Molecular Weight | 650.851 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS3570 |