| SpectraBase Compound ID | IXuA49K4FIV |
|---|---|
| InChI | InChI=1S/C30H44O3/c1-18(2)20-10-13-30(25(32)33)15-14-27(5)21(24(20)30)8-9-23-28(27,6)12-11-22-26(3,4)16-19(17-31)29(22,23)7/h16-17,20-24H,1,8-15H2,2-7H3,(H,32,33)/t20-,21-,22+,23+,24-,27-,28-,29+,30+/m1/s1 |
| InChIKey | GUPQNHIGLNUBOG-MKIMOCIHSA-N |
| Mol Weight | 452.7 g/mol |
| Molecular Formula | C30H44O3 |
| Exact Mass | 452.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LKkVjvt0sTz |
|---|---|
| Name | ZIZYBERENALIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O3 |
| InChI | InChI=1S/C30H44O3/c1-18(2)20-10-13-30(25(32)33)15-14-27(5)21(24(20)30)8-9-23-28(27,6)12-11-22-26(3,4)16-19(17-31)29(22,23)7/h16-17,20-24H,1,8-15H2,2-7H3,(H,32,33)/t20-,21-,22+,23+,24-,27-,28-,29+,30+/m1/s1 |
| InChIKey | GUPQNHIGLNUBOG-MKIMOCIHSA-N |
| Literature Reference Author | S.S.LEE,S.N.SHY,K.C.S.LIU |
| Literature Reference Citation | PHYTOCHEM.,46,549(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00313-0 |
| Molecular Weight | 452.678 g/mol |
| Sample ID | 45443 |
| Solvent | C5D5N |