![(6-S,13-S)-6-O-[6-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-CLERODA-3,14-DIENE-13-OL](/api/spectrum/AWTGv7ijj2m/structure.png?h=300&w=458 "(6-S,13-S)-6-O-[6-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-CLERODA-3,14-DIENE-13-OL")
| SpectraBase Compound ID | 1PQykc9p7YL |
|---|---|
| InChI | InChI=1S/C34H56O12/c1-9-32(6,41)13-14-33(7)18(3)15-23(34(8)17(2)11-10-12-22(33)34)45-30-28(40)26(38)29(19(4)43-30)46-31-27(39)25(37)24(36)21(44-31)16-42-20(5)35/h9,11,18-19,21-31,36-41H,1,10,12-16H2,2-8H3/t18-,19-,21-,22-,23+,24-,25+,26-,27-,28+,29-,30-,31+,32?,33+,34+/m1/s1 |
| InChIKey | IMXJXMRIIXFXKS-PGLDYFJHSA-N |
| Mol Weight | 656.8 g/mol |
| Molecular Formula | C34H56O12 |
| Exact Mass | 656.377177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AWTGv7ijj2m |
|---|---|
| Name | (6-S,13-S)-6-O-[6-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-CLERODA-3,14-DIENE-13-OL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H56O12 |
| InChI | InChI=1S/C34H56O12/c1-9-32(6,41)13-14-33(7)18(3)15-23(34(8)17(2)11-10-12-22(33)34)45-30-28(40)26(38)29(19(4)43-30)46-31-27(39)25(37)24(36)21(44-31)16-42-20(5)35/h9,11,18-19,21-31,36-41H,1,10,12-16H2,2-8H3/t18-,19-,21-,22-,23+,24-,25+,26-,27-,28+,29-,30-,31+,32?,33+,34+/m1/s1 |
| InChIKey | IMXJXMRIIXFXKS-PGLDYFJHSA-N |
| Literature Reference Author | X.L.LI,L.M.YANG,Y.ZHAO,R.R.WANG,G.XU,Y.T.ZHENG,L.TU,L.Y.PENG ,X.CHENG,Q.S.ZHAO |
| Literature Reference Citation | J.NAT.PROD.,70,265(2007) |
| Literature Reference DOI | 10.1021/np0603166 |
| Molecular Weight | 656.811 g/mol |
| Sample ID | 29652 |
| Solvent | C5D5N |