| SpectraBase Compound ID | JuXxjUyaXNl |
|---|---|
| InChI | InChI=1S/C27H40O6/c1-16(32-18(3)29)23-8-9-25-22-7-6-20-14-21(33-19(4)30)10-12-26(20,5)24(22)11-13-27(23,25)15-31-17(2)28/h11,16,20-23,25H,6-10,12-15H2,1-5H3 |
| InChIKey | GOAAHSIFJRXXGL-UHFFFAOYSA-N |
| Mol Weight | 460.6 g/mol |
| Molecular Formula | C27H40O6 |
| Exact Mass | 460.282489 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KtxKiVMJd8N |
|---|---|
| Name | Pregn-9(11)-ene-3,18.20-triol, triacetate |
| Alternate Name(s) | 18,20-Bis(acetyloxy)pregn-9(11)-en-3-yl acetate [3-acetoxy-17-(1-acetoxyethyl)-10-methyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl acetate [3-acetyloxy-17-(1-acetyloxyethyl)-10-methyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl acetate [3-acetyloxy-17-(1-acetyloxyethyl)-10-methyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl ethanoate Acetic acid [3-acetyloxy-17-(1-acetyloxyethyl)-10-methyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H40O6 |
| InChI | InChI=1S/C27H40O6/c1-16(32-18(3)29)23-8-9-25-22-7-6-20-14-21(33-19(4)30)10-12-26(20,5)24(22)11-13-27(23,25)15-31-17(2)28/h11,16,20-23,25H,6-10,12-15H2,1-5H3 |
| InChIKey | GOAAHSIFJRXXGL-UHFFFAOYSA-N |
| Molecular Weight | 460.611 g/mol |
| SMILES | C1(CCC2(C(C1)CCC1C2=CCC2(C1CCC2C(C)OC(C)=O)COC(C)=O)C)OC(C)=O |
| SPLASH | splash10-0006-6934000000-8e49658391bad9fdb29e |
| Wiley ID | 1485763 |