| SpectraBase Compound ID | AFPvFpvzmpH |
|---|---|
| InChI | InChI=1S/C55H88O20/c1-26(2)27(3)19-41(58)72-40-24-39-52(8)16-14-33(20-32(52)13-17-54(39,62)55(63)18-15-34(28(4)57)53(40,55)9)70-42-21-35(64-10)48(29(5)67-42)73-43-22-36(65-11)49(30(6)68-43)74-44-23-37(66-12)50(31(7)69-44)75-51-47(61)46(60)45(59)38(25-56)71-51/h13,19,26,29-31,33-40,42-51,56,59-63H,14-18,20-25H2,1-12H3/b27-19+/t29-,30+,31-,33+,34+,35+,36-,37-,38+,39-,40-,42+,43-,44+,45+,46-,47+,48-,49+,50-,51-,52+,53+,54+,55-/m1/s1 |
| InChIKey | SKPRNGQNSMEIOL-SGRZBUJPSA-N |
| Mol Weight | 1069.3 g/mol |
| Molecular Formula | C55H88O20 |
| Exact Mass | 1068.586895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Cry8tWwRW2 |
|---|---|
| Name | CYNANCHOSIDE-D2;CYNANCHOGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPY |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H88O20 |
| InChI | InChI=1S/C55H88O20/c1-26(2)27(3)19-41(58)72-40-24-39-52(8)16-14-33(20-32(52)13-17-54(39,62)55(63)18-15-34(28(4)57)53(40,55)9)70-42-21-35(64-10)48(29(5)67-42)73-43-22-36(65-11)49(30(6)68-43)74-44-23-37(66-12)50(31(7)69-44)75-51-47(61)46(60)45(59)38(25-56)71-51/h13,19,26,29-31,33-40,42-51,56,59-63H,14-18,20-25H2,1-12H3/b27-19+/t29-,30+,31-,33+,34+,35+,36-,37-,38+,39-,40-,42+,43-,44+,45+,46-,47+,48-,49+,50-,51-,52+,53+,54+,55-/m1/s1 |
| InChIKey | SKPRNGQNSMEIOL-SGRZBUJPSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | PHYTOCHEM.,44,917(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00640-1 |
| Molecular Weight | 1069.292 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWPA328 |