| SpectraBase Compound ID | H0JqFp9GVZp |
|---|---|
| InChI | InChI=1S/C55H90O18/c1-14-38-34(9)72-54(64,26-42(38)68-46-24-40(56)50(62)36(11)66-46)32(7)48(60)30(5)52-28(3)20-16-18-23-45(59)71-53(29(4)21-17-19-22-44(58)70-52)31(6)49(61)33(8)55(65-13)27-43(39(15-2)35(10)73-55)69-47-25-41(57)51(63)37(12)67-47/h16-23,28-43,46-53,56-57,60-64H,14-15,24-27H2,1-13H3/b20-16-,21-17-,22-19-,23-18-/t28-,29?,30-,31-,32-,33-,34+,35+,36+,37-,38+,39+,40+,41-,42+,43+,46+,47-,48+,49+,50-,51+,52-,53-,54+,55+/m1/s1 |
| InChIKey | IQUQYYTZXBLSTO-VCGUAVDZSA-N |
| Mol Weight | 1039.3 g/mol |
| Molecular Formula | C55H90O18 |
| Exact Mass | 1038.612716 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7QmnpvxKWoR |
|---|---|
| Name | 11-MONOMETHYLELAIOPHYLIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H90O18 |
| InChI | InChI=1S/C55H90O18/c1-14-38-34(9)72-54(64,26-42(38)68-46-24-40(56)50(62)36(11)66-46)32(7)48(60)30(5)52-28(3)20-16-18-23-45(59)71-53(29(4)21-17-19-22-44(58)70-52)31(6)49(61)33(8)55(65-13)27-43(39(15-2)35(10)73-55)69-47-25-41(57)51(63)37(12)67-47/h16-23,28-43,46-53,56-57,60-64H,14-15,24-27H2,1-13H3/b20-16-,21-17-,22-19-,23-18-/t28-,29?,30-,31-,32-,33-,34+,35+,36+,37-,38+,39+,40+,41-,42+,43+,46+,47-,48+,49+,50-,51+,52-,53-,54+,55+/m1/s1 |
| InChIKey | IQUQYYTZXBLSTO-VCGUAVDZSA-N |
| Literature Reference Author | M.RITZAU,S.HEINZE,W.F.FLECK,H.M.DAHSE,U.GRAEFE |
| Literature Reference Citation | J.NAT.PROD.,61,1337(1998) |
| Literature Reference DOI | 10.1021/np9800351 |
| Molecular Weight | 1039.309 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS19594 |