| SpectraBase Compound ID | 3UBitoTtjlJ |
|---|---|
| InChI | InChI=1S/C30H50O4/c1-25(2,33)13-9-14-30(8,34)19-10-16-29(7)24(19)20(31)18-22-27(5)15-12-23(32)26(3,4)21(27)11-17-28(22,29)6/h9,13,19-22,24,31,33-34H,10-12,14-18H2,1-8H3/b13-9+/t19-,20+,21?,22+,24-,27-,28+,29-,30-/m0/s1 |
| InChIKey | FVTMFCOOGHXVFJ-LOZOCNFVSA-N |
| Mol Weight | 474.7 g/mol |
| Molecular Formula | C30H50O4 |
| Exact Mass | 474.37091 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Huoch9XlNiw |
|---|---|
| Name | 12.beta.,20S,25-Trihydroxy-dammar-23-en-3-one |
| Alternate Name(s) | (12beta,14beta,23E)-12,20,25-trihydroxydammar-23-en-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O4 |
| InChI | InChI=1S/C30H50O4/c1-25(2,33)13-9-14-30(8,34)19-10-16-29(7)24(19)20(31)18-22-27(5)15-12-23(32)26(3,4)21(27)11-17-28(22,29)6/h9,13,19-22,24,31,33-34H,10-12,14-18H2,1-8H3/b13-9+/t19-,20+,21?,22+,24-,27-,28+,29-,30-/m0/s1 |
| InChIKey | FVTMFCOOGHXVFJ-LOZOCNFVSA-N |
| Molecular Weight | 474.726 g/mol |
| SMILES | O[C@@](C\C=C\C(O)(C)C)([C@@]1([C@@]2([C@@]([C@]3([C@]([C@]4(CCC(C(C4CC3)(C)C)=O)C)([H])C[C@]2(O)[H])C)(CC1)C)[H])[H])C |
| SPLASH | splash10-0a4i-0102900000-35d8960597a408d499f8 |
| Source of Spectrum | X4-22-170-0 |
| Wiley ID | 1585949 |