| SpectraBase Compound ID | 4wZgAuHnyMq |
|---|---|
| InChI | InChI=1S/C35H44O18/c1-15-27(50-22(40)10-7-18-5-8-19(44-4)9-6-18)29(47-16(2)38)30(48-17(3)39)34(46-15)51-28-20-11-12-45-32(23(20)35(14-37)31(28)53-35)52-33-26(43)25(42)24(41)21(13-36)49-33/h5-12,15,20-21,23-34,36-37,41-43H,13-14H2,1-4H3/b10-7+/t15-,20-,21+,23-,24+,25-,26+,27-,28+,29+,30+,31+,32+,33-,34-,35-/m1/s1 |
| InChIKey | BARAUATXLYPTGX-GEIOAOOOSA-N |
| Mol Weight | 752.7 g/mol |
| Molecular Formula | C35H44O18 |
| Exact Mass | 752.252765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9TI2gtQwRqD |
|---|---|
| Name | SCROPHULOSIDE-A7 |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H44O18 |
| InChI | InChI=1S/C35H44O18/c1-15-27(50-22(40)10-7-18-5-8-19(44-4)9-6-18)29(47-16(2)38)30(48-17(3)39)34(46-15)51-28-20-11-12-45-32(23(20)35(14-37)31(28)53-35)52-33-26(43)25(42)24(41)21(13-36)49-33/h5-12,15,20-21,23-34,36-37,41-43H,13-14H2,1-4H3/b10-7+/t15-,20-,21+,23-,24+,25-,26+,27-,28+,29+,30+,31+,32+,33-,34-,35-/m1/s1 |
| InChIKey | BARAUATXLYPTGX-GEIOAOOOSA-N |
| Literature Reference Author | T.MIYASE,A.MIMATSU |
| Literature Reference Citation | J.NAT.PROD.,62,1079(1999) |
| Literature Reference DOI | 10.1021/np9805746 |
| Molecular Weight | 752.724 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCP8758 |