| SpectraBase Compound ID | 6A8qHfGgKgc |
|---|---|
| InChI | InChI=1S/C32H52O3/c1-19-10-13-29(6)16-17-32(9)27(26(29)20(19)2)22(34)18-24-30(7)14-12-25(35-21(3)33)28(4,5)23(30)11-15-31(24,32)8/h19-20,23-27H,10-18H2,1-9H3 |
| InChIKey | UFMIHPLWOVWPHJ-UHFFFAOYSA-N |
| Mol Weight | 484.8 g/mol |
| Molecular Formula | C32H52O3 |
| Exact Mass | 484.391646 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L4NdT0A9M7j |
|---|---|
| Name | Ursan-12-one, 3-(acetyloxy)-, (3.beta.)- |
| CAS Registry Number | 55887-96-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H52O3 |
| InChI | InChI=1S/C32H52O3/c1-19-10-13-29(6)16-17-32(9)27(26(29)20(19)2)22(34)18-24-30(7)14-12-25(35-21(3)33)28(4,5)23(30)11-15-31(24,32)8/h19-20,23-27H,10-18H2,1-9H3 |
| InChIKey | UFMIHPLWOVWPHJ-UHFFFAOYSA-N |
| Molecular Weight | 484.765 g/mol |
| SMILES | CC1(C(CCC2(C1CCC1(C2CC(=O)C2C1(CCC1(C2C(C(CC1)C)C)C)C)C)C)OC(=O)C)C |
| SPLASH | splash10-02ai-0090600000-1a9f518516647cea6196 |
| Source of Spectrum | Va-0-0-0 |
| Synonyms | 12-Oxoursan-3-yl acetate (4,4,6a,6b,8a,11,12,14b-octamethyl-13-oxidanylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12,12a,14,14a-hexadecahydropicen-3-yl) ethanoate (4,4,6a,6b,8a,11,12,14b-octamethyl-13-oxo-1,2,3,4a,5,6,6a,7,8,9,10,11,12,12a,14,14a-hexadecahydropicen-3-yl) acetate Acetic acid (13-keto-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,9,10,11,12,12a,14,14a-hexadecahydropicen-3-yl) ester Acetic acid (4,4,6a,6b,8a,11,12,14b-octamethyl-13-oxo-1,2,3,4a,5,6,6a,7,8,9,10,11,12,12a,14,14a-hexadecahydropicen-3-yl) ester |
| Wiley ID | 739186 |