| SpectraBase Compound ID | JeAapn9lpTI |
|---|---|
| InChI | InChI=1S/C30H48O2/c1-20(10-9-16-26(2,3)32)21-15-17-30(8)24-13-11-22-23(12-14-25(31)27(22,4)5)28(24,6)18-19-29(21,30)7/h9,11,13,16,20-21,24-25,31-32H,10,12,14-15,17-19H2,1-8H3/b16-9+/t20-,21-,24?,25+,28+,29-,30+/m1/s1 |
| InChIKey | MNIOCWIESUAIEQ-QIKQWZDRSA-N |
| Mol Weight | 440.7 g/mol |
| Molecular Formula | C30H48O2 |
| Exact Mass | 440.365431 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 24IUKsH0oMl |
|---|---|
| Name | Cucurbita-5(10),6,23(E)-triene-3.beta.,25-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48O2 |
| InChI | InChI=1S/C30H48O2/c1-20(10-9-16-26(2,3)32)21-15-17-30(8)24-13-11-22-23(12-14-25(31)27(22,4)5)28(24,6)18-19-29(21,30)7/h9,11,13,16,20-21,24-25,31-32H,10,12,14-15,17-19H2,1-8H3/b16-9+/t20-,21-,24?,25+,28+,29-,30+/m1/s1 |
| InChIKey | MNIOCWIESUAIEQ-QIKQWZDRSA-N |
| Molecular Weight | 440.712 g/mol |
| SMILES | OC(\C=C\C[C@]([C@]1(CC[C@]2(C3[C@](C4=C(C([C@](CC4)(O)[H])(C)C)C=C3)(CC[C@]12C)C)C)[H])(C)[H])(C)C |
| SPLASH | splash10-052r-9807300000-bf980a9492c42547036e |
| Source of Spectrum | G4-71-1330-5 |
| Wiley ID | 1695017 |