| SpectraBase Compound ID | GiZW4F0APsW |
|---|---|
| InChI | InChI=1S/C35H52O15/c1-16-30(50-31-29(43)28(42)27(41)23(13-36)49-31)21(38)10-25(47-16)48-18-3-7-33(15-37)19-4-6-32(2)26(17-9-24(40)46-14-17)22(39)12-35(32,45)20(19)5-8-34(33,44)11-18/h9,15-16,18-23,25-31,36,38-39,41-45H,3-8,10-14H2,1-2H3/t16-,18-,19?,20?,21+,22-,23-,25+,26-,27-,28+,29-,30+,31+,32+,33-,34-,35-/m0/s1 |
| InChIKey | PLMWECYQRHDXMP-JFXKDFCWSA-N |
| Mol Weight | 712.8 g/mol |
| Molecular Formula | C35H52O15 |
| Exact Mass | 712.330621 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCmBPu4gd4w |
|---|---|
| Name | CHEIRANTHOSIDE-I;STROPHADOGENIN-3-O-BETA-GLUCOPYRANOSYL-(1->4)-BETA-BOIVIOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H52O15 |
| InChI | InChI=1S/C35H52O15/c1-16-30(50-31-29(43)28(42)27(41)23(13-36)49-31)21(38)10-25(47-16)48-18-3-7-33(15-37)19-4-6-32(2)26(17-9-24(40)46-14-17)22(39)12-35(32,45)20(19)5-8-34(33,44)11-18/h9,15-16,18-23,25-31,36,38-39,41-45H,3-8,10-14H2,1-2H3/t16-,18-,19?,20?,21+,22-,23-,25+,26-,27-,28+,29-,30+,31+,32+,33-,34-,35-/m0/s1 |
| InChIKey | PLMWECYQRHDXMP-JFXKDFCWSA-N |
| Literature Reference Author | Z.H.LEI,S.YAHARA,T.NOHARA,T.B.SHAN,J.Z.XIONG |
| Literature Reference Citation | PHYTOCHEM.,41,1187(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00764-4 |
| Molecular Weight | 712.789 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4313 |