| SpectraBase Compound ID | Lcu9LXw0KLz |
|---|---|
| InChI | InChI=1S/C27H38O14/c1-4-12-13(5-6-28)16(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)23(33)39-17-7-14-15(11(17)2)9-37-25(35)19(14)24(34)36-3/h4,6,10-15,17-22,25-27,29-32,35H,1,5,7-9H2,2-3H3/t11-,12-,13+,14+,15-,17+,18+,19+,20+,21-,22+,25?,26+,27?/m1/s1 |
| InChIKey | XAAJXCMPBSAMLQ-FLIZAAJXSA-N |
| Mol Weight | 586.6 g/mol |
| Molecular Formula | C27H38O14 |
| Exact Mass | 586.226156 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ISftbmGVFvL |
|---|---|
| Name | LACINIATOSIDE-1;MAJOR-ISOMER |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O14 |
| InChI | InChI=1S/C27H38O14/c1-4-12-13(5-6-28)16(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)23(33)39-17-7-14-15(11(17)2)9-37-25(35)19(14)24(34)36-3/h4,6,10-15,17-22,25-27,29-32,35H,1,5,7-9H2,2-3H3/t11-,12-,13+,14+,15-,17+,18+,19+,20+,21-,22+,25?,26+,27?/m1/s1 |
| InChIKey | XAAJXCMPBSAMLQ-FLIZAAJXSA-N |
| Literature Reference Author | A.KOCSIS,L.F.SZABO,B.PODANYI |
| Literature Reference Citation | J.NAT.PROD.,56,1486(1993) |
| Literature Reference DOI | 10.1021/np50099a007 |
| Molecular Weight | 586.590 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS18521 |