SpectraBase Compound ID | JthnekpPW29 |
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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-QHPUVITPSA-N |
Mol Weight | 426.7 g/mol |
Molecular Formula | C30H50O |
Exact Mass | 426.386166 g/mol |
SpectraBase Spectrum ID | 4FRdviNhbsa |
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Name | .beta.-Amyrin |
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-QHPUVITPSA-N |
Molecular Weight | 426.729 g/mol |
SMILES | O[C@@]1(C([C@@]2(CC[C@]3([C@]4(C([C@@]5(CC(C)(C)CC[C@@]5(CC4)C)[H])=CC[C@@]3([C@]2(CC1)C)[H])C)C)[H])(C)C)[H] |
SPLASH | splash10-014i-0190000000-5084faa6383163e54aba |
Source of Spectrum | QA-38-396-J |
Wiley ID | 861300 |