| SpectraBase Compound ID | 9ZvkFSCwB9p |
|---|---|
| InChI | InChI=1S/C42H68O12/c1-20-29(46)31(48)33(50)35(51-20)54-34-32(49)30(47)23(19-43)52-36(34)53-28-16-26(44)42(9)24(38(28,4)5)12-13-41(8)25(42)11-10-21-22-17-37(2,3)18-27(45)39(22,6)14-15-40(21,41)7/h10-11,20,23-36,43-50H,12-19H2,1-9H3/t20-,23+,24-,25-,26+,27+,28-,29-,30+,31+,32-,33+,34+,35-,36-,39+,40+,41+,42-/m0/s1 |
| InChIKey | CJLCWNDABGLLHV-NXWLSAEISA-N |
| Mol Weight | 765.0 g/mol |
| Molecular Formula | C42H68O12 |
| Exact Mass | 764.471078 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LwwLEvSTTzG |
|---|---|
| Name | 3-BETA-O-ALPHA-RHAMNOPYRANOSYL-(1->2)-BETA-GLUCOPYRANOSYL-OLEAN-11,13(18)-DIEN-1-BETA,3-BETA,22-BETA-TRIOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O12 |
| InChI | InChI=1S/C42H68O12/c1-20-29(46)31(48)33(50)35(51-20)54-34-32(49)30(47)23(19-43)52-36(34)53-28-16-26(44)42(9)24(38(28,4)5)12-13-41(8)25(42)11-10-21-22-17-37(2,3)18-27(45)39(22,6)14-15-40(21,41)7/h10-11,20,23-36,43-50H,12-19H2,1-9H3/t20-,23+,24-,25-,26+,27+,28-,29-,30+,31+,32-,33+,34+,35-,36-,39+,40+,41+,42-/m0/s1 |
| InChIKey | CJLCWNDABGLLHV-NXWLSAEISA-N |
| Literature Reference Author | Z.Z.IBRAHEIM,H.A.HASSANEAN,D.W.BISHAY |
| Literature Reference Citation | PHYTOCHEM.,62,1201(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00620-9 |
| Molecular Weight | 764.995 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU29621 |