| SpectraBase Compound ID | LEfs2TsPNsW |
|---|---|
| InChI | InChI=1S/C28H48O6/c1-14(2)15(3)24(31)25(32)16(4)18-7-8-19-17-13-34-26(33)21-11-22(29)23(30)12-28(21,6)20(17)9-10-27(18,19)5/h14-25,29-32H,7-13H2,1-6H3/t15-,16+,17?,18?,19?,20?,21-,22+,23-,24+,25+,27-,28-/m1/s1 |
| InChIKey | IXVMHGVQKLDRKH-VGTRZSOOSA-N |
| Mol Weight | 480.7 g/mol |
| Molecular Formula | C28H48O6 |
| Exact Mass | 480.345089 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9oC2wuahzrr |
|---|---|
| Name | (22S,23S,24R)-2.alpha.,3.alpha.,22,23-Tetrahydroxy-B-homo-7-oxa-5.alpha.-ergostan-6-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H48O6 |
| InChI | InChI=1S/C28H48O6/c1-14(2)15(3)24(31)25(32)16(4)18-7-8-19-17-13-34-26(33)21-11-22(29)23(30)12-28(21,6)20(17)9-10-27(18,19)5/h14-25,29-32H,7-13H2,1-6H3/t15-,16+,17?,18?,19?,20?,21-,22+,23-,24+,25+,27-,28-/m1/s1 |
| InChIKey | IXVMHGVQKLDRKH-VGTRZSOOSA-N |
| Molecular Weight | 480.686 g/mol |
| SMILES | O[C@]([C@]([C@](C1CCC2C3COC([C@@]4([C@](C[C@]([C@](C4)(O)[H])(O)[H])(C3CC[C@]12C)C)[H])=O)(C)[H])(O)[H])([C@@](C(C)C)(C)[H])[H] |
| SPLASH | splash10-004i-0009200000-dae42aab300dc9b9f001 |
| Source of Spectrum | SO-0-427-3 |
| Wiley ID | 1540603 |