| SpectraBase Compound ID | 1qlUxfqbrmI |
|---|---|
| InChI | InChI=1S/C27H44O7/c1-23(2,32)22(31)8-10-26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-9-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15?,17-,19+,20-,21-,22?,24+,25+,26?,27+/m0/s1 |
| InChIKey | VUBCOFCCIFBERZ-WLVVIQIMSA-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 | AUrnwJiq8gV |
|---|---|
| Name | PINNASTERONE |
| 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/c1-23(2,32)22(31)8-10-26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-9-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15?,17-,19+,20-,21-,22?,24+,25+,26?,27+/m0/s1 |
| InChIKey | VUBCOFCCIFBERZ-WLVVIQIMSA-N |
| Literature Reference Author | A.SUKSAMRARN,C.SOMMECHAI,P.CHARULPONG,B.CHITKUL |
| Literature Reference Citation | PHYTOCHEM.,38,473(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00712-3 |
| Molecular Weight | 480.642 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4808 |