| SpectraBase Compound ID | Ahx9199kvAn |
|---|---|
| InChI | InChI=1S/C34H54O7/c1-19(35)39-21-16-23-31(8)17-22(40-20(2)36)27(32(9)12-11-25(41-32)29(5,6)38)30(31,7)14-15-33(23)18-34(33)13-10-24(37)28(3,4)26(21)34/h21-27,37-38H,10-18H2,1-9H3/t21-,22?,23?,24?,25+,26?,27?,30+,31-,32-,33-,34+/m0/s1 |
| InChIKey | KZYJFRBHWCGQSY-PZDXREALSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C34H54O7 |
| Exact Mass | 574.386954 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J5hBXkkCmss |
|---|---|
| Name | 6,16-Diacetyl-cyclosieversigenin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H54O7 |
| InChI | InChI=1S/C34H54O7/c1-19(35)39-21-16-23-31(8)17-22(40-20(2)36)27(32(9)12-11-25(41-32)29(5,6)38)30(31,7)14-15-33(23)18-34(33)13-10-24(37)28(3,4)26(21)34/h21-27,37-38H,10-18H2,1-9H3/t21-,22?,23?,24?,25+,26?,27?,30+,31-,32-,33-,34+/m0/s1 |
| InChIKey | KZYJFRBHWCGQSY-PZDXREALSA-N |
| Molecular Weight | 574.799 g/mol |
| SMILES | OC1C(C2[C@@]3([C@@]4(CC[C@@]5(C([C@]6(O[C@@](C(O)(C)C)(CC6)[H])C)C(C[C@]5(C4C[C@@]2(OC(=O)C)[H])C)OC(=O)C)C)C3)CC1)(C)C |
| SPLASH | splash10-002g-0903410000-973e096e5238478d372a |
| Source of Spectrum | X4-17-417-0 |
| Wiley ID | 1585400 |