| SpectraBase Compound ID | 3uluh86jlb1 |
|---|---|
| InChI | InChI=1S/C30H42O4/c1-16-22-19(34-25(16)33)15-27(4)12-13-29(6)17(23(22)27)8-9-20-28(5)11-10-21(32)26(2,3)24(28)18(31)14-30(20,29)7/h17,19-20,22-24H,1,8-15H2,2-7H3/t17-,19?,20+,22+,23+,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | BZYBPXXQSABSLD-IKHOMOINSA-N |
| Mol Weight | 466.7 g/mol |
| Molecular Formula | C30H42O4 |
| Exact Mass | 466.30831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DDRBJShUdHI |
|---|---|
| Name | Ochraceolide C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H42O4 |
| InChI | InChI=1S/C30H42O4/c1-16-22-19(34-25(16)33)15-27(4)12-13-29(6)17(23(22)27)8-9-20-28(5)11-10-21(32)26(2,3)24(28)18(31)14-30(20,29)7/h17,19-20,22-24H,1,8-15H2,2-7H3/t17-,19?,20+,22+,23+,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | BZYBPXXQSABSLD-IKHOMOINSA-N |
| Molecular Weight | 466.662 g/mol |
| SMILES | [C@]12([C@]3([C@@]([C@@]4([C@@]5(C(C(=O)OC5C[C@@]4(CC3)C)=C)[H])[H])([H])CC[C@@]2([C@]2(CCC(C([C@@]2(C(C1)=O)[H])(C)C)=O)C)[H])C)C |
| SPLASH | splash10-014l-9380700000-622be1240b5bf9bffa7c |
| Source of Spectrum | X2-54-1358-3 |
| Wiley ID | 1604197 |