| SpectraBase Compound ID | EWKP1Rv9ui3 |
|---|---|
| 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+/m0/s1 |
| InChIKey | BARAUATXLYPTGX-IWVSXRIWSA-N |
| Mol Weight | 752.7 g/mol |
| Molecular Formula | C35H44O18 |
| Exact Mass | 752.252765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 218nJyLtFNd |
|---|---|
| Name | SCROVALENTINOSIDE |
| Compound Number | 95 |
| 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+/m0/s1 |
| InChIKey | BARAUATXLYPTGX-IWVSXRIWSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,Y.HARIGAYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,159(2007) |
| Literature Reference DOI | 10.1248/cpb.55.159 |
| Molecular Weight | 752.724 g/mol |
| Sample ID | 37892 |
| Solvent | CD3OD:C6D6=10:1 |