![6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-5-HYDROXY-2-METHOXY-7-PHENYLPHENALEN-1-ONE](/api/spectrum/9tzxvP6JheZ/structure.png?h=300&w=458 "6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-5-HYDROXY-2-METHOXY-7-PHENYLPHENALEN-1-ONE")
| SpectraBase Compound ID | JhGRVmWv4Ba |
|---|---|
| InChI | InChI=1S/C28H26N2O11/c1-38-17-10-13-9-16(31)25(20-14(12-5-3-2-4-6-12)7-8-15(19(13)20)21(17)32)41-26-24(35)23(34)22(33)18(40-26)11-39-28(37)30-27(29)36/h2-10,18,22-24,26,31,33-35H,11H2,1H3,(H3,29,30,36,37)/t18-,22-,23+,24-,26+/m1/s1 |
| InChIKey | JYJNJXIQBMQWMU-OKOABTSWSA-N |
| Mol Weight | 566.52 g/mol |
| Molecular Formula | C28H26N2O11 |
| Exact Mass | 566.15366 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9tzxvP6JheZ |
|---|---|
| Name | 6-O-[(6''-O-ALLOPHANYL)-BETA-D-GLUCOPYRANOSYL]-5-HYDROXY-2-METHOXY-7-PHENYLPHENALEN-1-ONE |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H26N2O11 |
| InChI | InChI=1S/C28H26N2O11/c1-38-17-10-13-9-16(31)25(20-14(12-5-3-2-4-6-12)7-8-15(19(13)20)21(17)32)41-26-24(35)23(34)22(33)18(40-26)11-39-28(37)30-27(29)36/h2-10,18,22-24,26,31,33-35H,11H2,1H3,(H3,29,30,36,37)/t18-,22-,23+,24-,26+/m1/s1 |
| InChIKey | JYJNJXIQBMQWMU-OKOABTSWSA-N |
| Literature Reference Author | S.OPITZ,D.HOELSCHER,N.J.OLDHAM,S.BARTRAM,B.SCHNEIDER |
| Literature Reference Citation | J.NAT.PROD.,65,1122(2002) |
| Literature Reference DOI | 10.1021/np020083s |
| Molecular Weight | 566.521 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI7014 |