| SpectraBase Compound ID | 24ZToptFBIm |
|---|---|
| InChI | InChI=1S/C32H58O17/c1-3-11-17(12-9-7-5-4-6-8-10-13-20(35)36)45-31-28(25(41)22(38)18(14-33)46-31)49-32-29(26(42)23(39)19(15-34)47-32)48-30-27(43)24(40)21(37)16(2)44-30/h16-19,21-34,37-43H,3-15H2,1-2H3,(H,35,36)/t16-,17-,18+,19+,21-,22+,23+,24+,25-,26-,27+,28+,29+,30-,31+,32-/m0/s1 |
| InChIKey | RWVPJPVFCOXOKZ-XASGQBQHSA-N |
| Mol Weight | 714.8 g/mol |
| Molecular Formula | C32H58O17 |
| Exact Mass | 714.3674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H7S6vp2iauK |
|---|---|
| Name | CUSCUTIC-ACID-A3;(11S)-CONVOLVULINOLIC-ACID-11-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-0-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H58O17 |
| InChI | InChI=1S/C32H58O17/c1-3-11-17(12-9-7-5-4-6-8-10-13-20(35)36)45-31-28(25(41)22(38)18(14-33)46-31)49-32-29(26(42)23(39)19(15-34)47-32)48-30-27(43)24(40)21(37)16(2)44-30/h16-19,21-34,37-43H,3-15H2,1-2H3,(H,35,36)/t16-,17-,18+,19+,21-,22+,23+,24+,25-,26-,27+,28+,29+,30-,31+,32-/m0/s1 |
| InChIKey | RWVPJPVFCOXOKZ-XASGQBQHSA-N |
| Literature Reference Author | X.M.DU,N.Y.SUN,M.NISHI,T.KAWASAKI,Y.T.GUO,K.MIYAHARA |
| Literature Reference Citation | J.NAT.PROD.,62,722(1999) |
| Literature Reference DOI | 10.1021/np980506j |
| Molecular Weight | 714.802 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP7613 |