| SpectraBase Compound ID | Kq7Vo09weRc |
|---|---|
| InChI | InChI=1S/C29H42O20/c1-42-12-5-11(6-13(43-2)18(12)35)3-4-17(34)46-26-20(37)15(8-31)48-29(26,10-33)49-28-24(41)22(39)25(16(9-32)45-28)47-27-23(40)21(38)19(36)14(7-30)44-27/h3-6,14-16,19-28,30-33,35-41H,7-10H2,1-2H3/b4-3+/t14?,15-,16+,19?,20-,21?,22+,23?,24+,25+,26+,27?,28+,29+/m1/s1 |
| InChIKey | JIAQZQOOHZCDKY-KXQHSCOXSA-N |
| Mol Weight | 710.6 g/mol |
| Molecular Formula | C29H42O20 |
| Exact Mass | 710.226944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BaKKQw6q9nM |
|---|---|
| Name | ARILLATOSE-F;O-BETA-GLUCOPYRANOSYL-(1->3)-ALPHA-D-GLUCOPYRANOSYL-3'-O-SINAPOYL-BETA-D-FRUCTOFURANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O20 |
| InChI | InChI=1S/C29H42O20/c1-42-12-5-11(6-13(43-2)18(12)35)3-4-17(34)46-26-20(37)15(8-31)48-29(26,10-33)49-28-24(41)22(39)25(16(9-32)45-28)47-27-23(40)21(38)19(36)14(7-30)44-27/h3-6,14-16,19-28,30-33,35-41H,7-10H2,1-2H3/b4-3+/t14?,15-,16+,19?,20-,21?,22+,23?,24+,25+,26+,27?,28+,29+/m1/s1 |
| InChIKey | JIAQZQOOHZCDKY-KXQHSCOXSA-N |
| Literature Reference Author | W.KOBAYASHI,T.MIYASE,S.SUZUKI,H.NOGUCHI,X.M.CHEN |
| Literature Reference Citation | J.NAT.PROD.,63,1066(2000) |
| Literature Reference DOI | 10.1021/np0000567 |
| Molecular Weight | 710.640 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU7352 |