| SpectraBase Compound ID | JjGjaaMkmoV |
|---|---|
| InChI | InChI=1S/C41H52O21/c1-15(2)6-11-20-22(57-39-31(51)29(49)26(46)23(13-42)58-39)12-21(45)25-28(48)37(35(60-36(20)25)18-7-9-19(54-5)10-8-18)61-41-33(53)38(34(16(3)55-41)56-17(4)44)62-40-32(52)30(50)27(47)24(14-43)59-40/h6-10,12,16,23-24,26-27,29-34,38-43,45-47,49-53H,11,13-14H2,1-5H3/t16-,23-,24+,26-,27+,29+,30-,31-,32+,33+,34-,38-,39-,40-,41-/m0/s1 |
| InChIKey | DSBGQYHARXPXRK-BNUBJZOQSA-N |
| Mol Weight | 880.8 g/mol |
| Molecular Formula | C41H52O21 |
| Exact Mass | 880.300109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 953wPzQFZWv |
|---|---|
| Name | EPIMEDIN-I;ANHYDROICARITIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-(4-O-ACETYL)-RHAMNOPYRANOSIDE-7-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H52O21 |
| InChI | InChI=1S/C41H52O21/c1-15(2)6-11-20-22(57-39-31(51)29(49)26(46)23(13-42)58-39)12-21(45)25-28(48)37(35(60-36(20)25)18-7-9-19(54-5)10-8-18)61-41-33(53)38(34(16(3)55-41)56-17(4)44)62-40-32(52)30(50)27(47)24(14-43)59-40/h6-10,12,16,23-24,26-27,29-34,38-43,45-47,49-53H,11,13-14H2,1-5H3/t16-,23-,24+,26-,27+,29+,30-,31-,32+,33+,34-,38-,39-,40-,41-/m0/s1 |
| InChIKey | DSBGQYHARXPXRK-BNUBJZOQSA-N |
| Literature Reference Author | P.SUN,Y.CHEN,N.SHIMIZU,T.TAKEDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,355(1998) |
| Literature Reference DOI | 10.1248/cpb.46.355 |
| Molecular Weight | 880.851 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS6239 |