| SpectraBase Compound ID | KyjgB86CDQu |
|---|---|
| InChI | InChI=1S/C30H44O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-12,17-20,23,31-32,36-37H,10,13-15H2,1-8H3/b12-11+/t17-,18+,19-,20+,23+,27+,28-,29+,30-/m1/s1 |
| InChIKey | SRPHMISUTWFFKJ-MKSGFSFGSA-N |
| Mol Weight | 516.7 g/mol |
| Molecular Formula | C30H44O7 |
| Exact Mass | 516.308704 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K4s9atmfzJ1 |
|---|---|
| Name | CUCURBITACIN-D;2-BETA,16-ALPHA,20,25-TETRAHYDROXY-9-METHYL-19-NOR-9-BETA,10-ALPHA-LANOSTA-5,23-DIENE-3,11-DIONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O7 |
| InChI | InChI=1S/C30H44O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-12,17-20,23,31-32,36-37H,10,13-15H2,1-8H3/b12-11+/t17-,18+,19-,20+,23+,27+,28-,29+,30-/m1/s1 |
| InChIKey | SRPHMISUTWFFKJ-MKSGFSFGSA-N |
| Literature Reference Author | C.SEGER,S.STURM,E.HASLINGER,H.STUPPNER |
| Literature Reference Citation | MH.CHEM.,136,1645(2005) |
| Literature Reference DOI | 10.1007/s00706-005-0347-2 |
| Molecular Weight | 516.675 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI23654 |