![13,30-Cyclo-29-nor-Dammarano[4,3-c]pyran-Derivative](/api/spectrum/JQ04gIKgE6p/structure.png?h=300&w=458 "13,30-Cyclo-29-nor-Dammarano[4,3-c]pyran-Derivative")
| SpectraBase Compound ID | IBTBymfFukz |
|---|---|
| InChI | InChI=1S/C39H50O6/c1-33(42-5)20-39(44-22-33)19-26(32(41)45-39)27-12-16-38-21-37(27,38)15-13-29-34(2)14-11-25-17-28(24-9-7-6-8-10-24)43-23-35(25,3)30(34)18-31(40)36(29,38)4/h6-11,19,27-31,40H,12-18,20-23H2,1-5H3/t27-,28-,29+,30+,31+,33-,34+,35-,36-,37+,38+,39+/m0/s1 |
| InChIKey | DUBRTGHCJCCRAJ-AFPXXGALSA-N |
| Mol Weight | 614.8 g/mol |
| Molecular Formula | C39H50O6 |
| Exact Mass | 614.360739 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JQ04gIKgE6p |
|---|---|
| Name | 13,30-Cyclo-29-nor-Dammarano[4,3-c]pyran-Derivative |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C39H50O6 |
| InChI | InChI=1S/C39H50O6/c1-33(42-5)20-39(44-22-33)19-26(32(41)45-39)27-12-16-38-21-37(27,38)15-13-29-34(2)14-11-25-17-28(24-9-7-6-8-10-24)43-23-35(25,3)30(34)18-31(40)36(29,38)4/h6-11,19,27-31,40H,12-18,20-23H2,1-5H3/t27-,28-,29+,30+,31+,33-,34+,35-,36-,37+,38+,39+/m0/s1 |
| InChIKey | DUBRTGHCJCCRAJ-AFPXXGALSA-N |
| Molecular Weight | 614.823 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@@](c5ccccc5)(OC3)[H])=CC2)C)([H])C1)C)[H])C4)C)[H] |
| SPLASH | splash10-001i-0200190000-e88c2d9f0eaabc9c9e88 |
| Source of Spectrum | G4-71-661-2 |
| Synonyms | Acutissima-triterpene B |
| Wiley ID | 1694930 |