| SpectraBase Compound ID | GkkEDvPDkYG |
|---|---|
| InChI | InChI=1S/C36H58O11/c1-31(2)11-13-36(30(45)47-29-26(42)25(41)24(40)20(16-37)46-29)14-12-34(5)18(23(36)28(31)44)7-8-22-32(3)15-19(39)27(43)33(4,17-38)21(32)9-10-35(22,34)6/h7,19-29,37-44H,8-17H2,1-6H3/t19-,20-,21-,22-,23-,24-,25+,26-,27-,28+,29+,32+,33+,34-,35-,36+/m1/s1 |
| InChIKey | CMZFNIMQBCBHEX-MMXCFLTLSA-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 | 4DplM3Ra218 |
|---|---|
| Name | 2-ALPHA,3-ALPHA,19-ALPHA,23-TETRAHYDROXY-URSOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O11 |
| InChI | InChI=1S/C36H58O11/c1-31(2)11-13-36(30(45)47-29-26(42)25(41)24(40)20(16-37)46-29)14-12-34(5)18(23(36)28(31)44)7-8-22-32(3)15-19(39)27(43)33(4,17-38)21(32)9-10-35(22,34)6/h7,19-29,37-44H,8-17H2,1-6H3/t19-,20-,21-,22-,23-,24-,25+,26-,27-,28+,29+,32+,33+,34-,35-,36+/m1/s1 |
| InChIKey | CMZFNIMQBCBHEX-MMXCFLTLSA-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 | UWPA3170 |