| SpectraBase Compound ID | Fxz1ObGKMtG |
|---|---|
| InChI | InChI=1S/C30H48O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,19-23,31-32,35H,9-16H2,1-7H3,(H,33,34)/t17-,19-,20+,21-,22-,23+,26?,27?,28?,29-,30+/m1/s1 |
| InChIKey | OXVUXGFZHDKYLS-LYZJXKLRSA-N |
| Mol Weight | 488.7 g/mol |
| Molecular Formula | C30H48O5 |
| Exact Mass | 488.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AlUyW3Yh2ab |
|---|---|
| Name | TORMENTIC_ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O5 |
| InChI | InChI=1S/C30H48O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,19-23,31-32,35H,9-16H2,1-7H3,(H,33,34)/t17-,19-,20+,21-,22-,23+,26?,27?,28?,29-,30+/m1/s1 |
| InChIKey | OXVUXGFZHDKYLS-LYZJXKLRSA-N |
| Literature Reference Author | M.SHIMIZU,N.UEMITSU,M.SHIROTA,K.MATSUMOTO,Y.TEZUKA |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,2181(1996) |
| Literature Reference DOI | 10.1248/cpb.44.2181 |
| Molecular Weight | 488.708 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ17358 |