| SpectraBase Compound ID | 3mHh2XrvzyL |
|---|---|
| InChI | InChI=1S/C33H44O18/c1-13-18(48-22(35)7-5-14-4-6-17(44-2)19(8-14)45-3)9-15-16(30(42)43)11-46-31(23(13)15)51-33-29(41)27(39)25(37)21(50-33)12-47-32-28(40)26(38)24(36)20(10-34)49-32/h4-8,11,13,15,18,20-21,23-29,31-34,36-41H,9-10,12H2,1-3H3,(H,42,43)/b7-5+/t13-,15+,18-,20-,21-,23+,24-,25-,26+,27+,28-,29-,31-,32-,33+/m0/s1 |
| InChIKey | ZUNFSURLOOAMBI-MDCVANLDSA-N |
| Mol Weight | 728.7 g/mol |
| Molecular Formula | C33H44O18 |
| Exact Mass | 728.252765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DTEQNALnHkt |
|---|---|
| Name | JAVANICOSIDE-B |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H44O18 |
| InChI | InChI=1S/C33H44O18/c1-13-18(48-22(35)7-5-14-4-6-17(44-2)19(8-14)45-3)9-15-16(30(42)43)11-46-31(23(13)15)51-33-29(41)27(39)25(37)21(50-33)12-47-32-28(40)26(38)24(36)20(10-34)49-32/h4-8,11,13,15,18,20-21,23-29,31-34,36-41H,9-10,12H2,1-3H3,(H,42,43)/b7-5+/t13-,15+,18-,20-,21-,23+,24-,25-,26+,27+,28-,29-,31-,32-,33+/m0/s1 |
| InChIKey | ZUNFSURLOOAMBI-MDCVANLDSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,R.BANIK |
| Literature Reference Citation | CHEM.PHARM.BULL.,59,803(2011) |
| Literature Reference DOI | 10.1248/cpb.59.803 |
| Molecular Weight | 728.702 g/mol |
| Source File Reference | UWIR3252 |