| SpectraBase Compound ID | H34DFunjNAC |
|---|---|
| InChI | InChI=1S/C27H48O7/c1-14(13-28)6-5-7-15(2)19-21(31)22(32)23-26(19,4)11-9-18-25(3)10-8-16(29)12-17(25)20(30)24(33)27(18,23)34/h14-24,28-34H,5-13H2,1-4H3/t14?,15-,16+,17-,18-,19+,20-,21-,22+,23-,24-,25+,26-,27+/m1/s1 |
| InChIKey | VHACFTUFOBCYNP-JFBZLKDJSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C27H48O7 |
| Exact Mass | 484.340004 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B0dvEZOojJY |
|---|---|
| Name | 5.alpha.-Cholestane-3.beta.,6.alpha.,7.alpha.,8.beta.,15.alpha.,16.beta.,26-heptaol |
| CAS Registry Number | 86414-94-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H48O7 |
| InChI | InChI=1S/C27H48O7/c1-14(13-28)6-5-7-15(2)19-21(31)22(32)23-26(19,4)11-9-18-25(3)10-8-16(29)12-17(25)20(30)24(33)27(18,23)34/h14-24,28-34H,5-13H2,1-4H3/t14?,15-,16+,17-,18-,19+,20-,21-,22+,23-,24-,25+,26-,27+/m1/s1 |
| InChIKey | VHACFTUFOBCYNP-JFBZLKDJSA-N |
| Molecular Weight | 484.674 g/mol |
| SMILES | OCC(CCC[C@]([C@@]1([C@@]2([C@]([C@@]3([C@@]([C@@]([C@]4(C[C@](CC[C@@]4([C@]3(CC2)[H])C)(O)[H])[H])(O)[H])(O)[H])O)([C@]([C@@]1(O)[H])(O)[H])[H])C)[H])(C)[H])C |
| SPLASH | splash10-0002-3489700000-a52ff148763b1efe8fbc |
| Source of Spectrum | X4-21-338-0 |
| Synonyms | (3S,5S,6R,7R,8S,9R,10S,13R,14S,15R,16R,17R)-10,13-dimethyl-17-[(2R)-6-methyl-7-oxidanyl-heptan-2-yl]-1,2,3,4,5,6,7,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,6,7,8,15,16-hexol (3S,5S,6R,7R,8S,9R,10S,13R,14S,15R,16R,17R)-17-[(1R)-6-hydroxy-1,5-dimethyl-hexyl]-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,6,7,8,15,16-hexol (3S,5S,6R,7R,8S,9R,10S,13R,14S,15R,16R,17R)-17-[(2R)-7-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,6,7,8,15,16-hexol Cholestane-3,6,7,8,15,16,26-heptol |
| Wiley ID | 1585813 |