| SpectraBase Compound ID | EmuctSOaoIH |
|---|---|
| InChI | InChI=1S/C32H50O17/c1-10(2)13-6-16(46-31-27(42)24(39)21(36)17(7-33)47-31)12(4)19-14(13)5-11(3)29(23(19)38)49-32-28(43)25(40)22(37)18(48-32)9-45-30-26(41)20(35)15(34)8-44-30/h5,10,12-13,15-18,20-22,24-28,30-43H,6-9H2,1-4H3/t12?,13?,15-,16?,17+,18-,20+,21+,22-,24-,25+,26-,27+,28-,30+,31+,32+/m0/s1 |
| InChIKey | YHXAOIONEYKJAQ-UCDPIEROSA-N |
| Mol Weight | 706.7 g/mol |
| Molecular Formula | C32H50O17 |
| Exact Mass | 706.3048 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4EqGYX0fQ4w |
|---|---|
| Name | ALANGICADINOSIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O17 |
| InChI | InChI=1S/C32H50O17/c1-10(2)13-6-16(46-31-27(42)24(39)21(36)17(7-33)47-31)12(4)19-14(13)5-11(3)29(23(19)38)49-32-28(43)25(40)22(37)18(48-32)9-45-30-26(41)20(35)15(34)8-44-30/h5,10,12-13,15-18,20-22,24-28,30-43H,6-9H2,1-4H3/t12?,13?,15-,16?,17+,18-,20+,21+,22-,24-,25+,26-,27+,28-,30+,31+,32+/m0/s1 |
| InChIKey | YHXAOIONEYKJAQ-UCDPIEROSA-N |
| Literature Reference Author | H.OTSUKA,M.YAO,E.HIRATA,A.TAKUSHI,Y.TAKEDA |
| Literature Reference Citation | PHYTOCHEM.,41,1351(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00799-7 |
| Molecular Weight | 706.739 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4378 |