| SpectraBase Compound ID | Jg6ad1S7NZC |
|---|---|
| InChI | InChI=1S/C21H32O14/c22-4-7-3-9(25)8-1-2-31-19(12(7)8)35-21-17(30)15(28)18(11(6-24)33-21)34-20-16(29)14(27)13(26)10(5-23)32-20/h1-3,8-30H,4-6H2/t8-,9+,10+,11-,12+,13+,14-,15-,16+,17-,18-,19-,20-,21+/m0/s1 |
| InChIKey | NLFVCKGGYZYWPM-CTJRBKOFSA-N |
| Mol Weight | 508.5 g/mol |
| Molecular Formula | C21H32O14 |
| Exact Mass | 508.179206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Szn2aX0OR4 |
|---|---|
| Name | AUCUBIGENIN-1-O-BETA-CELLOBIOSIDE |
| Compound Number | 60 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O14 |
| InChI | InChI=1S/C21H32O14/c22-4-7-3-9(25)8-1-2-31-19(12(7)8)35-21-17(30)15(28)18(11(6-24)33-21)34-20-16(29)14(27)13(26)10(5-23)32-20/h1-3,8-30H,4-6H2/t8-,9+,10+,11-,12+,13+,14-,15-,16+,17-,18-,19-,20-,21+/m0/s1 |
| InChIKey | NLFVCKGGYZYWPM-CTJRBKOFSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 508.477 g/mol |
| Solvent | D2O |
| Source File Reference | UWMZ16054 |