| SpectraBase Compound ID | DSjPf75lap5 |
|---|---|
| InChI | InChI=1S/C51H72N4O17/c1-29(18-19-41(72-51(62)44(24-56)65-10)33(5)47(70-34(6)58)30(2)20-21-55(7)28-57)42(64-9)23-43-32(4)40(63-8)16-13-17-45-52-37(26-67-45)49-54-38(27-69-49)50-53-36(25-68-50)48(66-11)31(3)39(60)15-12-14-35(59)22-46(61)71-43/h12-13,15,17,20-21,25-33,35,40-44,47-48,56,59H,14,16,18-19,22-24H2,1-11H3/b15-12-,17-13-,21-20+ |
| InChIKey | WMQWIJXGKYDMAH-XLFLCJKISA-N |
| Mol Weight | 1013.1 g/mol |
| Molecular Formula | C51H72N4O17 |
| Exact Mass | 1012.489247 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CAiBoYyOQnb |
|---|---|
| Name | 38-HYDROXYMYCALOLIDE-B;MAJOR-ISOMER |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H72N4O17 |
| InChI | InChI=1S/C51H72N4O17/c1-29(18-19-41(72-51(62)44(24-56)65-10)33(5)47(70-34(6)58)30(2)20-21-55(7)28-57)42(64-9)23-43-32(4)40(63-8)16-13-17-45-52-37(26-67-45)49-54-38(27-69-49)50-53-36(25-68-50)48(66-11)31(3)39(60)15-12-14-35(59)22-46(61)71-43/h12-13,15,17,20-21,25-33,35,40-44,47-48,56,59H,14,16,18-19,22-24H2,1-11H3/b15-12-,17-13-,21-20+ |
| InChIKey | WMQWIJXGKYDMAH-XLFLCJKISA-N |
| Literature Reference Author | S.MATSUNAGA,T.SUGAWARA,N.FUSETANI |
| Literature Reference Citation | J.NAT.PROD.,61,1164(1998) |
| Literature Reference DOI | 10.1021/np980102r |
| Molecular Weight | 1013.149 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCP2162 |