| SpectraBase Compound ID | 2vI0dsUPgBN |
|---|---|
| InChI | InChI=1S/C29H34O14/c1-12-22(33)24(35)26(37)28(40-12)39-11-20-23(34)25(36)27(38)29(43-20)42-19-9-15(31)6-7-16(19)17-10-21(32)41-18(17)8-13-2-4-14(30)5-3-13/h2-7,9-10,12,18,20,22-31,33-38H,8,11H2,1H3/t12-,18?,20+,22-,23+,24+,25-,26+,27+,28+,29+/m1/s1 |
| InChIKey | OOKTUPFXORHAKH-JMOCLLBMSA-N |
| Mol Weight | 606.6 g/mol |
| Molecular Formula | C29H34O14 |
| Exact Mass | 606.194856 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DMxAr2HSozf |
|---|---|
| Name | PUEROSIDE-A |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H34O14 |
| InChI | InChI=1S/C29H34O14/c1-12-22(33)24(35)26(37)28(40-12)39-11-20-23(34)25(36)27(38)29(43-20)42-19-9-15(31)6-7-16(19)17-10-21(32)41-18(17)8-13-2-4-14(30)5-3-13/h2-7,9-10,12,18,20,22-31,33-38H,8,11H2,1H3/t12-,18?,20+,22-,23+,24+,25-,26+,27+,28+,29+/m1/s1 |
| InChIKey | OOKTUPFXORHAKH-JMOCLLBMSA-N |
| Literature Reference Author | T.NOHARA,J.KINJO,J.FURUSAWA,Y.SAKAI,M.INOUE,Y.SHIRATAKI,Y.IS HIBASHI,I.YOKOE,M.KO |
| Literature Reference Citation | PHYTOCHEM.,33,1207(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85050-2 |
| Molecular Weight | 606.581 g/mol |
| Solvent | DMSO-D6 |