![17-(1,5-Dimethylhexyl)-3-hydroxy-10,13-dimethyl-1,2,3,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one](/api/spectrum/DuavI1a6TQX/structure.png?h=300&w=458 "17-(1,5-Dimethylhexyl)-3-hydroxy-10,13-dimethyl-1,2,3,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one")
| SpectraBase Compound ID | DAI2Iln9DVb |
|---|---|
| InChI | InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-23,28H,6-14,16H2,1-5H3 |
| InChIKey | NCHPULCZWCKWHV-UHFFFAOYSA-N |
| Mol Weight | 400.6 g/mol |
| Molecular Formula | C27H44O2 |
| Exact Mass | 400.334131 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DuavI1a6TQX |
|---|---|
| Name | 17-(1,5-Dimethylhexyl)-3-hydroxy-10,13-dimethyl-1,2,3,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one |
| Alternate Name(s) | 10,13-dimethyl-17-(6-methylheptan-2-yl)-3-oxidanyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one 17-(1,5-dimethylhexyl)-3-hydroxy-10,13-dimethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one 3-Hydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one 3-Hydroxycholest-4-en-6-one Cholest-4-en-6-on-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H44O2 |
| InChI | InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-23,28H,6-14,16H2,1-5H3 |
| InChIKey | NCHPULCZWCKWHV-UHFFFAOYSA-N |
| Molecular Weight | 400.647 g/mol |
| SMILES | OC1C=C2C(C3C(C4C(C(C(C)CCCC(C)C)CC4)(CC3)C)CC2=O)(CC1)C |
| SPLASH | splash10-0udi-9811500000-f5e276735668591fcc36 |
| Wiley ID | 1474788 |