| SpectraBase Compound ID | 5oOvbxGtWST |
|---|---|
| InChI | InChI=1S/C53H58O30/c1-18-34(58)39(63)43(67)50(76-18)75-17-33-38(62)42(66)46(70)53(83-33)80-30-14-25-26(55)12-24(13-29(25)79-47(30)21-10-27(56)35(59)28(57)11-21)78-52-45(69)41(65)37(61)32(82-52)16-74-49(72)20-4-8-23(9-5-20)77-51-44(68)40(64)36(60)31(81-51)15-73-48(71)19-2-6-22(54)7-3-19/h2-14,18,31-34,36-46,50-53,58,60-70H,15-17H2,1H3,(H4-,54,55,56,57,59,71)/p+1/t18-,31+,32-,33+,34-,36+,37-,38+,39+,40-,41+,42-,43+,44+,45-,46+,50+,51+,52-,53+/m0/s1 |
| InChIKey | YODABPUZPVYDEF-CCEMHZCUSA-O |
| Mol Weight | 1176.0 g/mol |
| Molecular Formula | C53H59O30 |
| Exact Mass | 1175.309115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SFSDn8sFMo |
|---|---|
| Name | VIOLDELPHIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H59O30 |
| InChI | InChI=1S/C53H58O30/c1-18-34(58)39(63)43(67)50(76-18)75-17-33-38(62)42(66)46(70)53(83-33)80-30-14-25-26(55)12-24(13-29(25)79-47(30)21-10-27(56)35(59)28(57)11-21)78-52-45(69)41(65)37(61)32(82-52)16-74-49(72)20-4-8-23(9-5-20)77-51-44(68)40(64)36(60)31(81-51)15-73-48(71)19-2-6-22(54)7-3-19/h2-14,18,31-34,36-46,50-53,58,60-70H,15-17H2,1H3,(H4-,54,55,56,57,59,71)/p+1/t18-,31+,32-,33+,34-,36+,37-,38+,39+,40-,41+,42-,43+,44+,45-,46+,50+,51+,52-,53+/m0/s1 |
| InChIKey | YODABPUZPVYDEF-CCEMHZCUSA-O |
| Literature Reference Author | K.TAKEDA,S.SATO,H.KOBAYASHI,Y.KANAITSUKA,M.UENO,T.KINOSHITA, H.TAZAKI,T.FUJIMORI |
| Literature Reference Citation | PHYTOCHEM.,36,613(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89784-8 |
| Molecular Weight | 1176.033 g/mol |
| Solvent | CD3OD:CF3CO2D=92:8 |
| Source File Reference | UWMS25642 |