SpectraBase Compound ID | Hz4ZAnMGiIX |
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InChI | InChI=1S/C30H48O4/c1-25(2)14-15-30(24(33)34)13-10-19-27(5)11-8-18-26(3,4)22(31)16-23(32)29(18,7)20(27)9-12-28(19,6)21(30)17-25/h10,18,20-23,31-32H,8-9,11-17H2,1-7H3,(H,33,34)/t18?,20?,21?,22-,23?,27-,28+,29?,30+/m0/s1 |
InChIKey | ODPNDPZKFUBRFF-VMFLBECYSA-N |
Mol Weight | 472.7 g/mol |
Molecular Formula | C30H48O4 |
Exact Mass | 472.35526 g/mol |
SpectraBase Spectrum ID | APovGoMNQdL |
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Name | 1.beta.-Hydroxy-Aleuritolic Acid |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C30H48O4 |
InChI | InChI=1S/C30H48O4/c1-25(2)14-15-30(24(33)34)13-10-19-27(5)11-8-18-26(3,4)22(31)16-23(32)29(18,7)20(27)9-12-28(19,6)21(30)17-25/h10,18,20-23,31-32H,8-9,11-17H2,1-7H3,(H,33,34)/t18?,20?,21?,22-,23?,27-,28+,29?,30+/m0/s1 |
InChIKey | ODPNDPZKFUBRFF-VMFLBECYSA-N |
Molecular Weight | 472.710 g/mol |
SMILES | O[C@@]1(C(C2CC[C@@]3(C(C2(C(C1)O)C)CC[C@@]1(C3=CC[C@]2(CCC(CC12)(C)C)C(=O)O)C)C)(C)C)[H] |
SPLASH | splash10-001r-0790200000-ca3fcba303577500cb4e |
Source of Spectrum | X2-58-8-8 |
Wiley ID | 1605812 |