| SpectraBase Compound ID | IpdyDeLfbtG |
|---|---|
| InChI | InChI=1S/C31H48O12/c1-14-15-5-6-19-29(2)8-4-9-30(3,28(39)43-27-24(38)22(36)21(35)17(12-32)41-27)18(29)7-10-31(19,11-15)25(14)42-26-23(37)20(34)16(33)13-40-26/h15-27,32-38H,1,4-13H2,2-3H3/t15-,16-,17+,18+,19+,20-,21+,22-,23+,24+,25-,26-,27-,29+,30-,31-/m1/s1 |
| InChIKey | KXWBAYNSAUYVAQ-KKNJCWBYSA-N |
| Mol Weight | 612.7 g/mol |
| Molecular Formula | C31H48O12 |
| Exact Mass | 612.314577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J8RO3jHdzKG |
|---|---|
| Name | RUFUSOSIDE-B;ENT-15-ALPHA-O-ALPHA-L-ARABINOPYRANOSYL-KAUREN-19-OIC-ACID-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O12 |
| InChI | InChI=1S/C31H48O12/c1-14-15-5-6-19-29(2)8-4-9-30(3,28(39)43-27-24(38)22(36)21(35)17(12-32)41-27)18(29)7-10-31(19,11-15)25(14)42-26-23(37)20(34)16(33)13-40-26/h15-27,32-38H,1,4-13H2,2-3H3/t15-,16-,17+,18+,19+,20-,21+,22-,23+,24+,25-,26-,27-,29+,30-,31-/m1/s1 |
| InChIKey | KXWBAYNSAUYVAQ-KKNJCWBYSA-N |
| Literature Reference Author | D.L.CHENG,X.P.CAO,J.K.CHENG,E.ROEDER |
| Literature Reference Citation | PHYTOCHEM.,32,151(1993) |
| Literature Reference DOI | 10.1016/0031-9422(92)80122-U |
| Molecular Weight | 612.715 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS3563 |