| SpectraBase Compound ID | HOtETZtJKe0 |
|---|---|
| InChI | InChI=1S/C42H72O12/c1-9-30(43)21-32-26(2)16-20-41(52-32)24-33-28(4)34(53-41)25-42(50)29(23-38(5,6)54-42)15-13-11-10-12-14-18-39(7,48)35(45)22-31(44)27(3)37(47)40(8,49)19-17-36(46)51-33/h13,15,17,19,26-35,37,43-45,47-50H,9-12,14,16,18,20-25H2,1-8H3/b15-13+,19-17+ |
| InChIKey | ISPDBGRYUFZEAU-ZJLNESDTSA-N |
| Mol Weight | 769.0 g/mol |
| Molecular Formula | C42H72O12 |
| Exact Mass | 768.502378 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I6b4Y8pNpOU |
|---|---|
| Name | DUNAIMYCIN-D2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H72O12 |
| InChI | InChI=1S/C42H72O12/c1-9-30(43)21-32-26(2)16-20-41(52-32)24-33-28(4)34(53-41)25-42(50)29(23-38(5,6)54-42)15-13-11-10-12-14-18-39(7,48)35(45)22-31(44)27(3)37(47)40(8,49)19-17-36(46)51-33/h13,15,17,19,26-35,37,43-45,47-50H,9-12,14,16,18,20-25H2,1-8H3/b15-13+,19-17+ |
| InChIKey | ISPDBGRYUFZEAU-ZJLNESDTSA-N |
| Literature Reference Author | J.E.HOCHLOWSKI,M.M.MULLALLY,G.M.BRILL,D.N.WHITTERN,A.M.BUKO, P.HILL,J.B.M.ALPINE |
| Literature Reference Citation | J.ANTIBIOTICS,44,1318(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.1318 |
| Molecular Weight | 769.026 g/mol |
| Sample ID | 66610 |
| Solvent | CDCl3 |