SpectraBase Compound ID | Jzos54olGjC |
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InChI | InChI=1S/C30H48O6/c1-18(8-7-15-34-19(2)31)25-11-12-26-24-10-9-22-16-23(35-20(3)32)13-14-29(22,5)27(24)17-28(30(25,26)6)36-21(4)33/h18,22-28H,7-17H2,1-6H3/t18-,22-,23-,24+,25-,26+,27+,28+,29+,30-/m1/s1 |
InChIKey | UDKZZKBWIGSKJH-KQWFBRKLSA-N |
Mol Weight | 504.7 g/mol |
Molecular Formula | C30H48O6 |
Exact Mass | 504.345089 g/mol |
SpectraBase Spectrum ID | EoxbQoH6iKY |
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Name | 3.alpha.,12.alpha.,24-tris(Acetoxy)-5.beta.-cholane |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C30H48O6 |
InChI | InChI=1S/C30H48O6/c1-18(8-7-15-34-19(2)31)25-11-12-26-24-10-9-22-16-23(35-20(3)32)13-14-29(22,5)27(24)17-28(30(25,26)6)36-21(4)33/h18,22-28H,7-17H2,1-6H3/t18-,22-,23-,24+,25-,26+,27+,28+,29+,30-/m1/s1 |
InChIKey | UDKZZKBWIGSKJH-KQWFBRKLSA-N |
Molecular Weight | 504.708 g/mol |
SMILES | [C@@]12([C@]([C@@]3(CC[C@]4([C@@]([C@]3(C[C@@]2(OC(=O)C)[H])[H])(CC[C@@](OC(=O)C)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](CCCOC(=O)C)(C)[H])[H])[H])C |
SPLASH | splash10-0a59-0095000000-818fcefb8ffb4b9add81 |
Source of Spectrum | C-121-6650-13 |
Wiley ID | 1700247 |