| SpectraBase Compound ID | 9ROGg3SUREp |
|---|---|
| InChI | InChI=1S/C22H32O16/c1-2-7-8(3-12(24)25)9(19(32)33)5-34-20(7)38-22-18(31)16(29)14(27)11(37-22)6-35-21-17(30)15(28)13(26)10(4-23)36-21/h2,5,7-8,10-11,13-18,20-23,26-31H,1,3-4,6H2,(H,24,25)(H,32,33)/t7-,8+,10+,11+,13+,14+,15-,16-,17+,18+,20+,21+,22-/m1/s1 |
| InChIKey | WBGQDSJKEPVMSV-YIXGZBDJSA-N |
| Mol Weight | 552.5 g/mol |
| Molecular Formula | C22H32O16 |
| Exact Mass | 552.169035 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CUokGl9dfOi |
|---|---|
| Name | 6'-O-BETA-GLUCOPYRANOSYL-SECOLOGANOSIDE |
| Compound Number | 131 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H32O16 |
| InChI | InChI=1S/C22H32O16/c1-2-7-8(3-12(24)25)9(19(32)33)5-34-20(7)38-22-18(31)16(29)14(27)11(37-22)6-35-21-17(30)15(28)13(26)10(4-23)36-21/h2,5,7-8,10-11,13-18,20-23,26-31H,1,3-4,6H2,(H,24,25)(H,32,33)/t7-,8+,10+,11+,13+,14+,15-,16-,17+,18+,20+,21+,22-/m1/s1 |
| InChIKey | WBGQDSJKEPVMSV-YIXGZBDJSA-N |
| Literature Reference Author | B.DINDA,D.R.CHOWDHURY,B.C.MOHANTA |
| Literature Reference Citation | CHEM.PHARM.BULL.,57,765(2009) |
| Literature Reference DOI | 10.1248/cpb.57.765 |
| Molecular Weight | 552.486 g/mol |
| Sample ID | 2729 |
| Solvent | CD3OD |