| SpectraBase Compound ID | 6tyTAyZVQkT |
|---|---|
| InChI | InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(38)33-23-24-34(42-33)32(39)22-21-29(36)18-15-14-16-19-30(37)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29?,30+,31-,32+,33?,34?/m0/s1 |
| InChIKey | NBVJDUCRUAUMAA-RHOBZEBSSA-N |
| Mol Weight | 596.9 g/mol |
| Molecular Formula | C35H64O7 |
| Exact Mass | 596.465204 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GktpD3bCZqc |
|---|---|
| Name | (cis)-Goniothalamicin |
| Alternate Name(s) | Javoricin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H64O7 |
| InChI | InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(38)33-23-24-34(42-33)32(39)22-21-29(36)18-15-14-16-19-30(37)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29?,30+,31-,32+,33?,34?/m0/s1 |
| InChIKey | NBVJDUCRUAUMAA-RHOBZEBSSA-N |
| Molecular Weight | 596.890 g/mol |
| SMILES | O[C@](CCCCCC(CC[C@](C1OC([C@@](O)(CCCCCCCCCCCCCC)[H])CC1)(O)[H])O)(CC=1C(O[C@](C1)(C)[H])=O)[H] |
| SPLASH | splash10-001i-0090000000-ffe133c486cad4df287d |
| Source of Spectrum | G4-59-107-3 |
| Wiley ID | 1606194 |