| SpectraBase Compound ID | 3QZ1xZbcJbr |
|---|---|
| InChI | InChI=1S/C30H48O5/c1-25(2)19-10-14-29(7)20(27(19,5)13-11-21(25)31)9-8-18-23-30(24(32)33,17-16-28(18,29)6)15-12-22(35-23)26(3,4)34/h18-20,22-23,34H,8-17H2,1-7H3,(H,32,33)/t18?,19?,20?,22-,23+,27-,28+,29+,30-/m0/s1 |
| InChIKey | HLKVOVRJUZIWNK-KQBBOQMLSA-N |
| Mol Weight | 488.7 g/mol |
| Molecular Formula | C30H48O5 |
| Exact Mass | 488.350175 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | izUfqE6GeK |
|---|---|
| Name | 17,24-Epoxy-25-hydroxy-3-oxobaccharan-21-oic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48O5 |
| InChI | InChI=1S/C30H48O5/c1-25(2)19-10-14-29(7)20(27(19,5)13-11-21(25)31)9-8-18-23-30(24(32)33,17-16-28(18,29)6)15-12-22(35-23)26(3,4)34/h18-20,22-23,34H,8-17H2,1-7H3,(H,32,33)/t18?,19?,20?,22-,23+,27-,28+,29+,30-/m0/s1 |
| InChIKey | HLKVOVRJUZIWNK-KQBBOQMLSA-N |
| Molecular Weight | 488.709 g/mol |
| SMILES | OC([C@]1(O[C@]2([C@](C(=O)O)(CC1)CC[C@]1([C@@]3(CCC4C(C(CC[C@@]4(C3CCC21)C)=O)(C)C)C)C)[H])[H])(C)C |
| SPLASH | splash10-0059-5210900000-ffc1c148c681f4336918 |
| Source of Spectrum | F-69-3358-4 |
| Wiley ID | 1595068 |