| SpectraBase Compound ID | JfYkHn9MRl6 |
|---|---|
| InChI | InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)16-25(29)27(19,5)24(21)13-14-26(22,23)4/h9-10,17-18,20,22-25,28-29H,6-8,11-16H2,1-5H3/t18-,20-,22-,23+,24+,25+,26-,27+/m1/s1 |
| InChIKey | PJEIBQWLLDBCCO-FDUUVPPLSA-N |
| Mol Weight | 400.6 g/mol |
| Molecular Formula | C27H44O2 |
| Exact Mass | 400.334131 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LZLRBkCE6SN |
|---|---|
| Name | (1alpha,3beta)-cholesta-5,7-diene-1,3-diol |
| Alternate Name(s) | (1S,3R,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol (1S,3R,9S,10R,13R,14R,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol CDABD Cholesta-5,7-diene-1,3-diol, (1alpha,3beta)- |
| CAS Registry Number | 43217-89-6 |
| 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)22-11-12-23-21-10-9-19-15-20(28)16-25(29)27(19,5)24(21)13-14-26(22,23)4/h9-10,17-18,20,22-25,28-29H,6-8,11-16H2,1-5H3/t18-,20-,22-,23+,24+,25+,26-,27+/m1/s1 |
| InChIKey | PJEIBQWLLDBCCO-FDUUVPPLSA-N |
| Molecular Weight | 400.647 g/mol |
| SMILES | O[C@@]1(CC2=CC=C3[C@@]([C@]2([C@](C1)(O)[H])C)(CC[C@]1([C@]3(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])[H] |
| SPLASH | splash10-0r0r-0809700000-99d9413c349f231c791e |
| Source of Spectrum | KC-1979-1697-0 |
| Wiley ID | 1369707 |