| SpectraBase Compound ID | CdDeVsdXFiH |
|---|---|
| InChI | InChI=1S/C32H46O16/c1-43-21-9-15(3-5-19(21)35)7-17(13-45-31-29(41)27(39)25(37)23(11-33)47-31)18(8-16-4-6-20(36)22(10-16)44-2)14-46-32-30(42)28(40)26(38)24(12-34)48-32/h3-6,9-10,17-18,23-42H,7-8,11-14H2,1-2H3/t17-,18-,23+,24+,25+,26+,27-,28-,29+,30+,31+,32+/m0/s1 |
| InChIKey | SBVBJPHMDABKJV-PGCJWIIOSA-N |
| Mol Weight | 686.7 g/mol |
| Molecular Formula | C32H46O16 |
| Exact Mass | 686.278585 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CPmKpuEfDaa |
|---|---|
| Name | (SECO)-ISOLARICIRESINOL-DIGLUCOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H46O16 |
| InChI | InChI=1S/C32H46O16/c1-43-21-9-15(3-5-19(21)35)7-17(13-45-31-29(41)27(39)25(37)23(11-33)47-31)18(8-16-4-6-20(36)22(10-16)44-2)14-46-32-30(42)28(40)26(38)24(12-34)48-32/h3-6,9-10,17-18,23-42H,7-8,11-14H2,1-2H3/t17-,18-,23+,24+,25+,26+,27-,28-,29+,30+,31+,32+/m0/s1 |
| InChIKey | SBVBJPHMDABKJV-PGCJWIIOSA-N |
| Literature Reference Author | S.S.MOREE,S.A.KHANUM,J.RAJESHA |
| Literature Reference Citation | FREE.RAD.ANTIOX.,1,31(2011) |
| Literature Reference DOI | 10.5530/ax.2011.4.6 |
| Molecular Weight | 686.708 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT15070 |