| SpectraBase Compound ID | IPwJziVhalv |
|---|---|
| InChI | InChI=1S/C30H41NO8/c1-5-34-25-14-21-13-23(38-27(21)39-25)28(4)18(2)12-24(37-26(33)20-8-7-11-31-15-20)30(17-35-19(3)32)22(28)9-6-10-29(30)16-36-29/h7-8,11,15,18,21-25,27H,5-6,9-10,12-14,16-17H2,1-4H3/t18-,21+,22-,23+,24+,25+,27-,28+,29+,30+/m1/s1 |
| InChIKey | QKISVSHUNJJKNY-CZIZJKDCSA-N |
| Mol Weight | 543.7 g/mol |
| Molecular Formula | C30H41NO8 |
| Exact Mass | 543.283217 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1iXUsmvdDXX |
|---|---|
| Name | SCUTEBARBATINE-J |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H41NO8 |
| InChI | InChI=1S/C30H41NO8/c1-5-34-25-14-21-13-23(38-27(21)39-25)28(4)18(2)12-24(37-26(33)20-8-7-11-31-15-20)30(17-35-19(3)32)22(28)9-6-10-29(30)16-36-29/h7-8,11,15,18,21-25,27H,5-6,9-10,12-14,16-17H2,1-4H3/t18-,21+,22-,23+,24+,25+,27-,28+,29+,30+/m1/s1 |
| InChIKey | QKISVSHUNJJKNY-CZIZJKDCSA-N |
| Literature Reference Author | S.J.DAI,D.D.LIANG,Y.REN,K.LIU,L.SHEN |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,207(2008) |
| Literature Reference DOI | 10.1248/cpb.56.207 |
| Molecular Weight | 543.657 g/mol |
| Sample ID | 1279 |
| Solvent | CDCl3 |