| SpectraBase Compound ID | LPCQ2oXfXt2 |
|---|---|
| InChI | InChI=1S/C42H70O14/c1-19-26(46)28(48)30(50)34(52-19)55-31-29(49)27(47)22(17-43)53-35(31)54-24-10-12-42-18-41(42)14-13-38(6)33(40(8)11-9-25(56-40)37(4,5)51)21(45)16-39(38,7)23(41)15-20(44)32(42)36(24,2)3/h19-35,43-51H,9-18H2,1-8H3/t19-,20-,21-,22+,23?,24-,25-,26-,27+,28+,29-,30+,31+,32?,33?,34-,35-,38+,39-,40+,41-,42+/m0/s1 |
| InChIKey | BVUAQQZYVCEVEJ-HEMDWGBJSA-N |
| Mol Weight | 799.0 g/mol |
| Molecular Formula | C42H70O14 |
| Exact Mass | 798.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJdmDFuBWno |
|---|---|
| Name | 20R,24S-EPOXY-9-BETA,19-CYClOLANOSTANE-3-BETA,6-ALPHA,16-BETA,25-TETROL-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H70O14 |
| InChI | InChI=1S/C42H70O14/c1-19-26(46)28(48)30(50)34(52-19)55-31-29(49)27(47)22(17-43)53-35(31)54-24-10-12-42-18-41(42)14-13-38(6)33(40(8)11-9-25(56-40)37(4,5)51)21(45)16-39(38,7)23(41)15-20(44)32(42)36(24,2)3/h19-35,43-51H,9-18H2,1-8H3/t19-,20-,21-,22+,23?,24-,25-,26-,27+,28+,29-,30+,31+,32?,33?,34-,35-,38+,39-,40+,41-,42+/m0/s1 |
| InChIKey | BVUAQQZYVCEVEJ-HEMDWGBJSA-N |
| Literature Reference Author | L.VEROTTA,M.GUERRINI,N.A.EL-SEBAKHY,A.M.ASSAD,S.M.TOAIMA,M.E .ABOU-SHEER,Y.D.LUO, |
| Literature Reference Citation | FITOTERAPIA,72,894(2001) |
| Literature Reference DOI | 10.1016/S0367-326X(01)00339-2 |
| Molecular Weight | 799.009 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4108 |