| SpectraBase Compound ID | 49ZwuAtlRT0 |
|---|---|
| InChI | InChI=1S/2C29H34O15/c2*1-39-12-5-3-11(4-6-12)14-7-13(32)19-16(41-14)8-15(40-2)20(23(19)35)27-28(25(37)22(34)17(9-30)42-27)44-29-26(38)24(36)21(33)18(10-31)43-29/h2*3-8,17-18,21-22,24-31,33-38H,9-10H2,1-2H3/t2*17-,18-,21-,22-,24+,25+,26-,27+,28-,29+/m11/s1 |
| InChIKey | UHUCEIDRIWRORA-IEBWYRPASA-N |
| Mol Weight | 1245.2 g/mol |
| Molecular Formula | C58H68O30 |
| Exact Mass | 1244.379541 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4p9eNFbuUI9 |
|---|---|
| Name | EMBINOIDIN;6-C-SOPHOROSYL-7,4'-DI-O-METHYL-APIGENIN |
| Compound Number | F4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H68O30 |
| InChI | InChI=1S/2C29H34O15/c2*1-39-12-5-3-11(4-6-12)14-7-13(32)19-16(41-14)8-15(40-2)20(23(19)35)27-28(25(37)22(34)17(9-30)42-27)44-29-26(38)24(36)21(33)18(10-31)43-29/h2*3-8,17-18,21-22,24-31,33-38H,9-10H2,1-2H3/t2*17-,18-,21-,22-,24+,25+,26-,27+,28-,29+/m11/s1 |
| InChIKey | UHUCEIDRIWRORA-IEBWYRPASA-N |
| Literature Reference Author | O.BJOROY,S.RAYYAN,T.FOSSEN,K.KALBERG,O.M.ANDERSEN |
| Literature Reference Citation | PHYTOCHEM.,70,278(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.12.012 |
| Molecular Weight | 1245.160 g/mol |
| Sample ID | 64517 |
| Solvent | CF3COOD:DMSO-D6=1:19 |