| SpectraBase Compound ID | ChiVnjK2eiH |
|---|---|
| InChI | InChI=1S/C29H46O7/c1-17(2)12-24(32)36-21-14-27(7)22(26(5,6)25(21)35-19(4)31)10-11-28-13-20(8-9-23(27)28)29(33,15-28)16-34-18(3)30/h17,20-23,25,33H,8-16H2,1-7H3/t20-,21-,22?,23?,25-,27+,28+,29+/m1/s1 |
| InChIKey | OKBXLPMREFRWLF-AXKIVMRISA-N |
| Mol Weight | 506.7 g/mol |
| Molecular Formula | C29H46O7 |
| Exact Mass | 506.324354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DDq52o6S52N |
|---|---|
| Name | 16R-2-ALPHA-(3-METHYLBUTANOYLOXY)-3-ALPHA,17-DIACETOXY-16-HYDROXYPHYLLOClADANE |
| Compound Number | 3B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O7 |
| InChI | InChI=1S/C29H46O7/c1-17(2)12-24(32)36-21-14-27(7)22(26(5,6)25(21)35-19(4)31)10-11-28-13-20(8-9-23(27)28)29(33,15-28)16-34-18(3)30/h17,20-23,25,33H,8-16H2,1-7H3/t20-,21-,22?,23?,25-,27+,28+,29+/m1/s1 |
| InChIKey | OKBXLPMREFRWLF-AXKIVMRISA-N |
| Literature Reference Author | G.LIU,P.RUEEDI |
| Literature Reference Citation | PHYTOCHEM.,41,1563(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00816-0 |
| Molecular Weight | 506.680 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU4465 |