| SpectraBase Compound ID | HFaRM1oHgRk |
|---|---|
| InChI | InChI=1S/C27H44O7/c1-11(2)9-27(34)10-12(3)17-19(27)23(32)18-16-13(6-7-25(17,18)4)26(5)14(20(29)22(16)31)8-15(28)21(30)24(26)33/h11-22,24,28-31,33-34H,6-10H2,1-5H3/t12-,13+,14-,15+,16-,17+,18+,19-,20-,21-,22-,24-,25-,26-,27-/m1/s1 |
| InChIKey | DGXRPSIAVFYMOL-GXUOCEDMSA-N |
| Mol Weight | 480.6 g/mol |
| Molecular Formula | C27H44O7 |
| Exact Mass | 480.308704 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 89YSzJcWAG5 |
|---|---|
| Name | XESTOBERGSTEROL-B |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O7 |
| InChI | InChI=1S/C27H44O7/c1-11(2)9-27(34)10-12(3)17-19(27)23(32)18-16-13(6-7-25(17,18)4)26(5)14(20(29)22(16)31)8-15(28)21(30)24(26)33/h11-22,24,28-31,33-34H,6-10H2,1-5H3/t12-,13+,14-,15+,16-,17+,18+,19-,20-,21-,22-,24-,25-,26-,27-/m1/s1 |
| InChIKey | DGXRPSIAVFYMOL-GXUOCEDMSA-N |
| Literature Reference Author | J.KOBAYASHI,H.SHINONAGA,H.SHIGEMORI,A.UMEYAMA,N.SHOJI,S.ARIH ARA |
| Literature Reference Citation | J.NAT.PROD.,58,312(1995) |
| Literature Reference DOI | 10.1021/np50116a029 |
| Molecular Weight | 480.642 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWVP6233 |