| SpectraBase Compound ID | FtuO7WXHDiA |
|---|---|
| InChI | InChI=1S/C31H46O6/c1-18(17-36-20(3)32)7-10-27(34)19(2)29-28(35)16-26-24-9-8-22-15-23(37-21(4)33)11-13-30(22,5)25(24)12-14-31(26,29)6/h8,18-19,23-26,29H,7,9-17H2,1-6H3 |
| InChIKey | SLRSTHDNKGLBAU-UHFFFAOYSA-N |
| Mol Weight | 514.7 g/mol |
| Molecular Formula | C31H46O6 |
| Exact Mass | 514.329439 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BvWpKwlDlrS |
|---|---|
| Name | Cholest-5-ene-16,22-dione, 3,26-bis(acetyloxy)-, (3.beta.,25R)- |
| Alternate Name(s) | 26-(Acetyloxy)-16,22-dioxocholest-5-en-3-yl acetate Cholest-5-ene-16,22-dione, 3.beta.,26-dihydroxy-, diacetate, (20S,25R)- Kryptogenin diacetate Kryptogenin-3,26-diacetate Acetic acid [6-(3-acetyloxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxoheptyl] ester [6-(3-acetyloxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxoheptyl] acetate [6-(3-acetoxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxo-heptyl] acetate [6-(3-acetyloxy-10,13-dimethyl-16-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxidanylidene-heptyl] ethanoate |
| CAS Registry Number | 7554-95-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H46O6 |
| InChI | InChI=1S/C31H46O6/c1-18(17-36-20(3)32)7-10-27(34)19(2)29-28(35)16-26-24-9-8-22-15-23(37-21(4)33)11-13-30(22,5)25(24)12-14-31(26,29)6/h8,18-19,23-26,29H,7,9-17H2,1-6H3 |
| InChIKey | SLRSTHDNKGLBAU-UHFFFAOYSA-N |
| Molecular Weight | 514.703 g/mol |
| SMILES | CC12C(C3C(C4(C)C(CC(CC4)OC(C)=O)=CC3)CC1)CC(C2C(C(CCC(COC(C)=O)C)=O)C)=O |
| SPLASH | splash10-0007-8779300000-472bd88be31307caa7cd |
| Source of Spectrum | AD-0-3948-0 |
| Wiley ID | 63438 |