| SpectraBase Compound ID | 3sDnZCiZi0e |
|---|---|
| InChI | InChI=1S/C30H42O5/c1-16(18(3)28(34)35-7)8-9-17(2)20-10-11-21-26-24(32)14-22-19(4)23(31)12-13-29(22,5)27(26)25(33)15-30(20,21)6/h17-22H,1,8-15H2,2-7H3/t17-,18?,19+,20?,21?,22?,29?,30?/m1/s1 |
| InChIKey | NZJIIJSJLBIJDO-ZJROQVHESA-N |
| Mol Weight | 482.7 g/mol |
| Molecular Formula | C30H42O5 |
| Exact Mass | 482.303224 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B3DJ5nIZ35M |
|---|---|
| Name | Zhankuic acid A - methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H42O5 |
| InChI | InChI=1S/C30H42O5/c1-16(18(3)28(34)35-7)8-9-17(2)20-10-11-21-26-24(32)14-22-19(4)23(31)12-13-29(22,5)27(26)25(33)15-30(20,21)6/h17-22H,1,8-15H2,2-7H3/t17-,18?,19+,20?,21?,22?,29?,30?/m1/s1 |
| InChIKey | NZJIIJSJLBIJDO-ZJROQVHESA-N |
| Molecular Weight | 482.661 g/mol |
| SMILES | C12=C(C3CCC(C3(CC2=O)C)[C@@](CCC(C(C(=O)OC)C)=C)(C)[H])C(=O)CC2C1(CCC(=O)[C@]2(C)[H])C |
| SPLASH | splash10-03e9-0098500000-6c06d796b7846f1d3be9 |
| Source of Spectrum | G4-58-1660-4 |
| Wiley ID | 1606077 |