| SpectraBase Compound ID | Ez49Luew2zf |
|---|---|
| InChI | InChI=1S/C30H48O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-23,25H,1,9-18H2,2-8H3/t20-,21?,22+,23?,25-,27-,28+,29-,30-/m1/s1 |
| InChIKey | GRBHNQFQFHLCHO-BNDLEMMWSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C30H48O |
| Exact Mass | 424.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7TN7Gu7fLSo |
|---|---|
| Name | Lupeone |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48O |
| InChI | InChI=1S/C30H48O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-23,25H,1,9-18H2,2-8H3/t20-,21?,22+,23?,25-,27-,28+,29-,30-/m1/s1 |
| InChIKey | GRBHNQFQFHLCHO-BNDLEMMWSA-N |
| Molecular Weight | 424.713 g/mol |
| SMILES | [C@]12([C@]3(C([C@]4(CCC(C([C@@]4(CC3)[H])(C)C)=O)C)CCC2[C@]2([C@@](C(=C)C)(CC[C@@]2(CC1)C)[H])[H])C)C |
| SPLASH | splash10-0a4i-0980200000-b519194023b048ab0c72 |
| Source of Spectrum | QA-45-107-12 |
| Wiley ID | 862772 |