SpectraBase Compound ID | BR9paZLO3LF |
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InChI | InChI=1S/C40H50O8/c1-34(43-5)18-40(47-20-34)17-25(33(42)48-40)26-9-13-39-19-38(26,39)12-10-30-35(2)11-8-24-15-28(23-6-7-27-29(14-23)46-22-45-27)44-21-36(24,3)31(35)16-32(41)37(30,39)4/h6-8,14,17,26,28,30-32,41H,9-13,15-16,18-22H2,1-5H3/t26-,28-,30+,31+,32+,34-,35+,36-,37-,38+,39+,40+/m0/s1 |
InChIKey | FMFUJZHVPRHFHL-PWAJUPHKSA-N |
Mol Weight | 658.8 g/mol |
Molecular Formula | C40H50O8 |
Exact Mass | 658.350569 g/mol |
SpectraBase Spectrum ID | 4praajj5AYJ |
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Name | 13,30-Cyclo-29-nor-Dammarano[4,3-c]pyran-Derivative |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C40H50O8 |
InChI | InChI=1S/C40H50O8/c1-34(43-5)18-40(47-20-34)17-25(33(42)48-40)26-9-13-39-19-38(26,39)12-10-30-35(2)11-8-24-15-28(23-6-7-27-29(14-23)46-22-45-27)44-21-36(24,3)31(35)16-32(41)37(30,39)4/h6-8,14,17,26,28,30-32,41H,9-13,15-16,18-22H2,1-5H3/t26-,28-,30+,31+,32+,34-,35+,36-,37-,38+,39+,40+/m0/s1 |
InChIKey | FMFUJZHVPRHFHL-PWAJUPHKSA-N |
Molecular Weight | 658.832 g/mol |
SMILES | O[C@]1([C@]2([C@@]34[C@]([C@@](C=5C(O[C@]6(C5)C[C@@](OC)(C)CO6)=O)([H])CC3)(CC[C@@]2([C@@]2([C@@]([C@@]3(C(C[C@@](c5cc6c(OCO6)cc5)(OC3)[H])=CC2)C)([H])C1)C)[H])C4)C)[H] |
SPLASH | splash10-004u-0420119000-4dd51af6e288a80bb194 |
Source of Spectrum | G4-71-661-3 |
Synonyms | Acutissima-triterpene A Acutissima-triterpene C |
Wiley ID | 1694929 |