SpectraBase Compound ID | KnYMKWVQaOo |
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InChI | InChI=1S/C22H26O7/c1-5-13(2)21(25)28-18-9-16(11-23)7-6-8-17(12-27-15(4)24)10-19-20(18)14(3)22(26)29-19/h5,7,10-11,18-20H,3,6,8-9,12H2,1-2,4H3/b13-5-,16-7+,17-10+/t18-,19?,20?/m1/s1 |
InChIKey | UVXIJAUHZZHZLZ-USBUAKISSA-N |
Mol Weight | 402.44 g/mol |
Molecular Formula | C22H26O7 |
Exact Mass | 402.167853 g/mol |
SpectraBase Spectrum ID | 5m31v2eZm5N |
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Name | 15-(Acetoxy)-8.beta.-[angeloyloxy]-14-oxo-(4Z)-acanthospermolide |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C22H26O7 |
InChI | InChI=1S/C22H26O7/c1-5-13(2)21(25)28-18-9-16(11-23)7-6-8-17(12-27-15(4)24)10-19-20(18)14(3)22(26)29-19/h5,7,10-11,18-20H,3,6,8-9,12H2,1-2,4H3/b13-5-,16-7+,17-10+/t18-,19?,20?/m1/s1 |
InChIKey | UVXIJAUHZZHZLZ-USBUAKISSA-N |
Molecular Weight | 402.443 g/mol |
SMILES | C1(C(C2[C@](OC(\C(=C/C)C)=O)(C\C(=C/CC\C(=C/C2O1)COC(=O)C)C=O)[H])=C)=O |
SPLASH | splash10-0udi-9011000000-eae309d3b4176ec84b00 |
Source of Spectrum | G4-63-1328-4 |
Wiley ID | 1608607 |