| SpectraBase Compound ID | FrAXNtYNRiU |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-21(2)10-7-11-22(3)12-8-13-23(4)18-25-19-30(28(33)35-25)27(14-9-17-31)26(24(5)20-32)15-16-29(30,6)34/h8,10,12-13,18,20,25,27-28,31,33-34H,7,9,11,14-17,19H2,1-6H3/b13-8+,22-12+,23-18+,26-24+/t25-,27+,28?,29-,30-/m0/s1 |
| InChIKey | UYSHRHKOHCLBCE-IKEVBOPBSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2A9T9dICFms |
|---|---|
| Name | IRIDOTECTORAL-A;IRIDOTECTRAL-A;MAJOR-EPIMER |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-21(2)10-7-11-22(3)12-8-13-23(4)18-25-19-30(28(33)35-25)27(14-9-17-31)26(24(5)20-32)15-16-29(30,6)34/h8,10,12-13,18,20,25,27-28,31,33-34H,7,9,11,14-17,19H2,1-6H3/b13-8+,22-12+,23-18+,26-24+/t25-,27+,28?,29-,30-/m0/s1 |
| InChIKey | UYSHRHKOHCLBCE-IKEVBOPBSA-N |
| Literature Reference Author | K.TAKAHASHI,Y.HOSHINO,S.SUZUKI,Y.HANO,T.NOMURA |
| Literature Reference Citation | PHYTOCHEM.,53,925(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00621-4 |
| Molecular Weight | 486.692 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU2232 |