| SpectraBase Compound ID | 5WG8gz5vIQH |
|---|---|
| InChI | InChI=1S/C20H26O3/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)17(23)16(13)22/h9-11,18,21H,6-8H2,1-5H3/t18-,20?/m0/s1 |
| InChIKey | KVTOPOITUALWOF-LROBGIAVSA-N |
| Mol Weight | 314.43 g/mol |
| Molecular Formula | C20H26O3 |
| Exact Mass | 314.188195 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | lOLoACWlbB |
|---|---|
| Name | Hypargenin C |
| Alternate Name(s) | (10aS)-6-hydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,10a-tetrahydrophenanthrene-9,10-dione (10aS)-6-hydroxy-7-isopropyl-1,1,4a-trimethyl-2,3,4,10a-tetrahydrophenanthrene-9,10-dione (10aS)-1,1,4a-trimethyl-6-oxidanyl-7-propan-2-yl-2,3,4,10a-tetrahydrophenanthrene-9,10-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O3 |
| InChI | InChI=1S/C20H26O3/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)17(23)16(13)22/h9-11,18,21H,6-8H2,1-5H3/t18-,20?/m0/s1 |
| InChIKey | KVTOPOITUALWOF-LROBGIAVSA-N |
| Molecular Weight | 314.425 g/mol |
| SMILES | Oc1c(C(C)C)cc2c(C3([C@@](C(C2=O)=O)(C(C)(C)CCC3)[H])C)c1 |
| SPLASH | splash10-01w1-0193000000-a43dcb5c42a1aef11769 |
| Source of Spectrum | X2-51-1183-3 |
| Wiley ID | 1602964 |