| SpectraBase Compound ID | Le1L9E3mNTV |
|---|---|
| InChI | InChI=1S/C29H32O16/c1-12(31)40-9-21-23(35)24(36)25(45-28-26(37)29(38,10-30)11-41-28)27(44-21)42-14-6-16(33)22-17(34)8-19(43-20(22)7-14)13-3-4-18(39-2)15(32)5-13/h3-8,21,23-28,30,32-33,35-38H,9-11H2,1-2H3/t21-,23-,24+,25-,26+,27-,28+,29-/m1/s1 |
| InChIKey | FGALOZIRMNCSRZ-MIKDDSNXSA-N |
| Mol Weight | 636.6 g/mol |
| Molecular Formula | C29H32O16 |
| Exact Mass | 636.169035 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JCmvDXxV17A |
|---|---|
| Name | DIOSMETIN-7-O-(2''-O-BETA-D-APIOFURANOSYL-6''-ACETYL-BETA-D-GLUCOPYRANOSIDE) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H32O16 |
| InChI | InChI=1S/C29H32O16/c1-12(31)40-9-21-23(35)24(36)25(45-28-26(37)29(38,10-30)11-41-28)27(44-21)42-14-6-16(33)22-17(34)8-19(43-20(22)7-14)13-3-4-18(39-2)15(32)5-13/h3-8,21,23-28,30,32-33,35-38H,9-11H2,1-2H3/t21-,23-,24+,25-,26+,27-,28+,29-/m1/s1 |
| InChIKey | FGALOZIRMNCSRZ-MIKDDSNXSA-N |
| Literature Reference Author | E.A.ABOURASHED,N.J.TOYANG,J.CHOINSKI,I.A.KHAN |
| Literature Reference Citation | J.NAT.PROD.,62,1179(1999) |
| Literature Reference DOI | 10.1021/np990063z |
| Molecular Weight | 636.563 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | WANG1617 |