| SpectraBase Compound ID | 7ra4uJltEXd |
|---|---|
| InChI | InChI=1S/C36H58O11/c1-17-10-11-36(30(44)47-29-25(42)24(41)23(40)21(16-37)46-29)13-12-33(5)18(26(36)35(17,7)45)8-9-22-32(4)14-20(39)28(43)31(2,3)27(32)19(38)15-34(22,33)6/h8,17,19-29,37-43,45H,9-16H2,1-7H3/t17-,19-,20-,21-,22-,23-,24+,25-,26-,27+,28-,29+,32-,33+,34-,35-,36+/m1/s1 |
| InChIKey | WKOLTWRXFQFZPV-JEFZZSRMSA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C36H58O11 |
| Exact Mass | 666.397913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CigEyGpZD6K |
|---|---|
| Name | 2-ALPHA,3-ALPHA,6-BETA,19-ALPHA-TETRAHYDROXY-URSOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O11 |
| InChI | InChI=1S/C36H58O11/c1-17-10-11-36(30(44)47-29-25(42)24(41)23(40)21(16-37)46-29)13-12-33(5)18(26(36)35(17,7)45)8-9-22-32(4)14-20(39)28(43)31(2,3)27(32)19(38)15-34(22,33)6/h8,17,19-29,37-43,45H,9-16H2,1-7H3/t17-,19-,20-,21-,22-,23-,24+,25-,26-,27+,28-,29+,32-,33+,34-,35-,36+/m1/s1 |
| InChIKey | WKOLTWRXFQFZPV-JEFZZSRMSA-N |
| Literature Reference Author | G.P.ZHOU,Y.YU,M.M.YUAN,T.JI,H.Z.FU,R.J.ZHONG |
| Literature Reference Citation | MOLECULES,20,9071(2015) |
| Literature Reference DOI | 10.3390/molecules20059071 |
| Molecular Weight | 666.850 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWPA3167 |