| SpectraBase Compound ID | 4RlUiT8NRM6 |
|---|---|
| InChI | InChI=1S/C30H44O8/c1-8-10-11-12-26(34)37-22-16-23-27(35-20(5)31)38-28(36-21(6)32)30(23)24(17-22)29(7,14-13-18(3)9-2)19(4)15-25(30)33/h9,13,16,19,22,24-25,27-28,33H,2,8,10-12,14-15,17H2,1,3-7H3/b18-13+/t19-,22-,24+,25+,27+,28-,29?,30-/m1/s1 |
| InChIKey | OWZBTGIYKSYHIP-JTFWVCSISA-N |
| Mol Weight | 532.7 g/mol |
| Molecular Formula | C30H44O8 |
| Exact Mass | 532.303618 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1RDQphgBVI1 |
|---|---|
| Name | CASEARVESTRIN-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O8 |
| InChI | InChI=1S/C30H44O8/c1-8-10-11-12-26(34)37-22-16-23-27(35-20(5)31)38-28(36-21(6)32)30(23)24(17-22)29(7,14-13-18(3)9-2)19(4)15-25(30)33/h9,13,16,19,22,24-25,27-28,33H,2,8,10-12,14-15,17H2,1,3-7H3/b18-13+/t19-,22-,24+,25+,27+,28-,29?,30-/m1/s1 |
| InChIKey | OWZBTGIYKSYHIP-JTFWVCSISA-N |
| Literature Reference Author | N.H.OBERLIES,J.P.BURGESS,H.A.NAVARRO,R.E.PINOS,C.R.FAIRCHILD ,R.W.PETERSON,D.D.SO |
| Literature Reference Citation | J.NAT.PROD.,65,95(2002) |
| Literature Reference DOI | 10.1021/np010459m |
| Molecular Weight | 532.675 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI2692 |