| SpectraBase Compound ID | DAnhcqcoTmX |
|---|---|
| InChI | InChI=1S/C29H44O9/c1-15-22(31)23(32)24(33)25(37-15)38-17-4-8-26(2)19-5-9-27(3)18(16-12-21(30)36-14-16)7-11-29(27,35)20(19)6-10-28(26,34)13-17/h12,15,17-20,22-25,31-35H,4-11,13-14H2,1-3H3/t15-,17+,18-,19?,20?,22-,23+,24-,25+,26-,27-,28+,29+/m1/s1 |
| InChIKey | RAWRNCRYFFPACC-GYYWFEEOSA-N |
| Mol Weight | 536.7 g/mol |
| Molecular Formula | C29H44O9 |
| Exact Mass | 536.298533 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KDIYmY6UN3x |
|---|---|
| Name | 3-O-BETA-D-QUINOVOPYRANOSYLPERIPLOGENIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O9 |
| InChI | InChI=1S/C29H44O9/c1-15-22(31)23(32)24(33)25(37-15)38-17-4-8-26(2)19-5-9-27(3)18(16-12-21(30)36-14-16)7-11-29(27,35)20(19)6-10-28(26,34)13-17/h12,15,17-20,22-25,31-35H,4-11,13-14H2,1-3H3/t15-,17+,18-,19?,20?,22-,23+,24-,25+,26-,27-,28+,29+/m1/s1 |
| InChIKey | RAWRNCRYFFPACC-GYYWFEEOSA-N |
| Literature Reference Author | T.M.WANG,T.HOJO,F.X.RAN,R.F.WANG,R.Q.WANG,H.B.CHEN,J.R.CUI,M .Y.SHANG,S.Q.CAI |
| Literature Reference Citation | J.NAT.PROD.,70,1429(2007) |
| Literature Reference DOI | 10.1021/np070150o |
| Molecular Weight | 536.663 g/mol |
| Sample ID | 31507 |
| Solvent | CD3OD |