| SpectraBase Compound ID | 9s0iizULXfb |
|---|---|
| InChI | InChI=1S/C30H40O7/c1-15-12-23(36-27(34)16(15)2)17(3)20-6-7-22-19-13-26-30(37-26)25(33)9-8-24(32)28(30,5)21(19)10-11-29(20,22)14-35-18(4)31/h8-9,17,19-23,25-26,33H,6-7,10-14H2,1-5H3/t17?,19-,20-,21+,22+,23-,25+,26-,28+,29+,30-/m1/s1 |
| InChIKey | ZQEYWCXMRUYTGT-PMWPOZATSA-N |
| Mol Weight | 512.6 g/mol |
| Molecular Formula | C30H40O7 |
| Exact Mass | 512.277404 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LpQFdSgHois |
|---|---|
| Name | WITHACNISTINE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O7 |
| InChI | InChI=1S/C30H40O7/c1-15-12-23(36-27(34)16(15)2)17(3)20-6-7-22-19-13-26-30(37-26)25(33)9-8-24(32)28(30,5)21(19)10-11-29(20,22)14-35-18(4)31/h8-9,17,19-23,25-26,33H,6-7,10-14H2,1-5H3/t17?,19-,20-,21+,22+,23-,25+,26-,28+,29+,30-/m1/s1 |
| InChIKey | ZQEYWCXMRUYTGT-PMWPOZATSA-N |
| Literature Reference Author | D.ALFONSO,I.KAPETANIDIS,G.BERNARDINELLI |
| Literature Reference Citation | J.NAT.PROD.,54,1576(1991) |
| Literature Reference DOI | 10.1021/np50078a013 |
| Molecular Weight | 512.643 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17467 |