| SpectraBase Compound ID | ApQe6O0qNIu |
|---|---|
| InChI | InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21?,22?,23?,24-,27+,28-,29+,30+/m0/s1 |
| InChIKey | JFSHUTJDVKUMTJ-KOMNAURRSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3XfQH9NhNkF |
|---|---|
| Name | Olean-12-en-3-ol, (3.beta.)- |
| Alternate Name(s) | Olean-12-en-3-ol (3-.beta.)-Olean-12-en-3-ol (3S,4aR,5R,6aR,6bR,8S,8aR,12aR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-picen-3-ol .beta.-Amyrenol .beta.-Amyrin 4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol Amyrin beta.-amyrenol beta.-amyrin Olean-12-en-3.beta.-ol EINECS 209-204-6 NSC 527971 |
| CAS Registry Number | 559-70-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O |
| InChI | InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21?,22?,23?,24-,27+,28-,29+,30+/m0/s1 |
| InChIKey | JFSHUTJDVKUMTJ-KOMNAURRSA-N |
| Molecular Weight | 426.729 g/mol |
| SMILES | O[C@@]1(C(C2CC[C@]3([C@]4(C(C5CC(C)(C)CC[C@@]5(CC4)C)=CCC3[C@]2(CC1)C)C)C)(C)C)[H] |
| SPLASH | splash10-0gb9-0190000000-63502aa6834e1e87fc91 |
| Source of Spectrum | E1-39-3134-3 |
| Wiley ID | 1519216 |