| SpectraBase Compound ID | 5QvXpB7whyN |
|---|---|
| InChI | InChI=1S/C44H46O26/c1-13(2)3-17(45)28-25(68-44-38(61)35(58)33(56)26(69-44)11-65-41(62)14-4-19(47)30(53)20(48)5-14)10-18(46)29(34(28)57)40-37(60)36(59)39(70-43(64)16-8-23(51)32(55)24(52)9-16)27(67-40)12-66-42(63)15-6-21(49)31(54)22(50)7-15/h4-10,13,26-27,33,35-40,44,46-61H,3,11-12H2,1-2H3/t26-,27-,33-,35+,36-,37-,38-,39-,40+,44-/m0/s1 |
| InChIKey | SAOGVRIDBHFPPY-ULGXZONSSA-N |
| Mol Weight | 990.8 g/mol |
| Molecular Formula | C44H46O26 |
| Exact Mass | 990.227732 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2xzu4O4gAAk |
|---|---|
| Name | KUNZEAPHLOGIN-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H46O26 |
| InChI | InChI=1S/C44H46O26/c1-13(2)3-17(45)28-25(68-44-38(61)35(58)33(56)26(69-44)11-65-41(62)14-4-19(47)30(53)20(48)5-14)10-18(46)29(34(28)57)40-37(60)36(59)39(70-43(64)16-8-23(51)32(55)24(52)9-16)27(67-40)12-66-42(63)15-6-21(49)31(54)22(50)7-15/h4-10,13,26-27,33,35-40,44,46-61H,3,11-12H2,1-2H3/t26-,27-,33-,35+,36-,37-,38-,39-,40+,44-/m0/s1 |
| InChIKey | SAOGVRIDBHFPPY-ULGXZONSSA-N |
| Literature Reference Author | N.KASAJIMA,H.ITO,T.HATANO,T.YOSHIDA |
| Literature Reference Citation | PHYTOCHEM.,69,3080(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.03.003 |
| Molecular Weight | 990.834 g/mol |
| Sample ID | 63858 |
| Solvent | ACETONE-D6:D2O |