| SpectraBase Compound ID | AjsgxHKJTqk |
|---|---|
| InChI | InChI=1S/C41H28O26/c42-11-1-7(2-12(43)23(11)47)37(58)64-16-6-63-38(59)8-3-13(44)24(48)27(51)17(8)18-9(4-14(45)25(49)28(18)52)39(60)65-34(16)36-35-32(56)22-21(41(62)66-35)20(30(54)33(57)31(22)55)19-10(40(61)67-36)5-15(46)26(50)29(19)53/h1-5,16,32,34-36,42-57H,6H2/t16?,32-,34?,35?,36?/m1/s1 |
| InChIKey | MMQXBTULXAEKQE-MUWRNFGLSA-N |
| Mol Weight | 936.6 g/mol |
| Molecular Formula | C41H28O26 |
| Exact Mass | 936.086881 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8lkcCwabN1F |
|---|---|
| Name | CASUARININ |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H28O26 |
| InChI | InChI=1S/C41H28O26/c42-11-1-7(2-12(43)23(11)47)37(58)64-16-6-63-38(59)8-3-13(44)24(48)27(51)17(8)18-9(4-14(45)25(49)28(18)52)39(60)65-34(16)36-35-32(56)22-21(41(62)66-35)20(30(54)33(57)31(22)55)19-10(40(61)67-36)5-15(46)26(50)29(19)53/h1-5,16,32,34-36,42-57H,6H2/t16?,32-,34?,35?,36?/m1/s1 |
| InChIKey | MMQXBTULXAEKQE-MUWRNFGLSA-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 | 936.658 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWCP7807 |