| SpectraBase Compound ID | 3a3YaqWM1q8 |
|---|---|
| InChI | InChI=1S/C42H30O27/c1-64-41(62)42(63)23-20-11(6-16(47)27(51)30(20)54)39(60)69-34(33-31(55)22(35(42)56)21(23)40(61)68-33)32-17(66-36(57)8-2-12(43)24(48)13(44)3-8)7-65-37(58)9-4-14(45)25(49)28(52)18(9)19-10(38(59)67-32)5-15(46)26(50)29(19)53/h2-6,17,23,31-34,43-55,63H,7H2,1H3/t17?,23-,31-,32?,33?,34?,42+/m0/s1 |
| InChIKey | SLFBWCUUJQOGFT-RUTFHNAWSA-N |
| Mol Weight | 966.7 g/mol |
| Molecular Formula | C42H30O27 |
| Exact Mass | 966.097446 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AMYbaPX5BT7 |
|---|---|
| Name | RHOIPTELEANIN-H |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H30O27 |
| InChI | InChI=1S/C42H30O27/c1-64-41(62)42(63)23-20-11(6-16(47)27(51)30(20)54)39(60)69-34(33-31(55)22(35(42)56)21(23)40(61)68-33)32-17(66-36(57)8-2-12(43)24(48)13(44)3-8)7-65-37(58)9-4-14(45)25(49)28(52)18(9)19-10(38(59)67-32)5-15(46)26(50)29(19)53/h2-6,17,23,31-34,43-55,63H,7H2,1H3/t17?,23-,31-,32?,33?,34?,42+/m0/s1 |
| InChIKey | SLFBWCUUJQOGFT-RUTFHNAWSA-N |
| Literature Reference Author | Z.H.JIANG,T.TANAKA,I.KOUNO |
| Literature Reference Citation | J.NAT.PROD.,62,425(1999) |
| Literature Reference DOI | 10.1021/np980361g |
| Molecular Weight | 966.684 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWCP7805 |