| SpectraBase Compound ID | I2vzerS6RB2 |
|---|---|
| InChI | InChI=1S/C27H36O13/c1-11(2)7-8-14-17(30)25(40-27-23(36)21(34)19(32)16(10-29)38-27)13-6-4-3-5-12(13)24(14)39-26-22(35)20(33)18(31)15(9-28)37-26/h3-7,15-16,18-23,26-36H,8-10H2,1-2H3/t15-,16-,18-,19-,20+,21+,22-,23-,26+,27+/m1/s1 |
| InChIKey | CSQAGHSISJPGCD-GIKBFHJQSA-N |
| Mol Weight | 568.6 g/mol |
| Molecular Formula | C27H36O13 |
| Exact Mass | 568.215591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GOthnfbIiZe |
|---|---|
| Name | LAPACHOL-1,4-DI-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36O13 |
| InChI | InChI=1S/C27H36O13/c1-11(2)7-8-14-17(30)25(40-27-23(36)21(34)19(32)16(10-29)38-27)13-6-4-3-5-12(13)24(14)39-26-22(35)20(33)18(31)15(9-28)37-26/h3-7,15-16,18-23,26-36H,8-10H2,1-2H3/t15-,16-,18-,19-,20+,21+,22-,23-,26+,27+/m1/s1 |
| InChIKey | CSQAGHSISJPGCD-GIKBFHJQSA-N |
| Literature Reference Author | W.CHEN,W.TANG,R.ZHANG,L.LOU,W.ZHAO |
| Literature Reference Citation | J.NAT.PROD.,70,567(2007) |
| Literature Reference DOI | 10.1021/np060515p |
| Molecular Weight | 568.575 g/mol |
| Sample ID | 30113 |
| Solvent | DMSO-D6 |