| SpectraBase Compound ID | 31EUdMFSPEd |
|---|---|
| InChI | InChI=1S/C60H90O14/c1-31-16-22-58(45(65)66)26-24-51(5)33(41(58)56(31,10)72)12-14-37-49(3)28-35(62)43(64)55(9,39(49)18-20-53(37,51)7)48(71)74-44-36(63)29-50(4)38-15-13-34-42-57(11,73)32(2)17-23-59(42,46(67)68)27-25-52(34,6)54(38,8)21-19-40(50)60(44,30-61)47(69)70/h12-13,31-32,35-44,61-64,72-73H,14-30H2,1-11H3,(H,65,66)(H,67,68)(H,69,70)/t31-,32+,35-,36+,37?,38?,39?,40?,41?,42?,43+,44+,49-,50+,51-,52+,53-,54+,55+,56-,57+,58+,59-,60+/m1/s1 |
| InChIKey | UWKKMKNUJLSCFX-AVQUHZHVSA-N |
| Mol Weight | 1035.4 g/mol |
| Molecular Formula | C60H90O14 |
| Exact Mass | 1034.633058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | t7PNyEE6h0 |
|---|---|
| Name | COREANOGENOIC-ACID |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H90O14 |
| InChI | InChI=1S/C60H90O14/c1-31-16-22-58(45(65)66)26-24-51(5)33(41(58)56(31,10)72)12-14-37-49(3)28-35(62)43(64)55(9,39(49)18-20-53(37,51)7)48(71)74-44-36(63)29-50(4)38-15-13-34-42-57(11,73)32(2)17-23-59(42,46(67)68)27-25-52(34,6)54(38,8)21-19-40(50)60(44,30-61)47(69)70/h12-13,31-32,35-44,61-64,72-73H,14-30H2,1-11H3,(H,65,66)(H,67,68)(H,69,70)/t31-,32+,35-,36+,37?,38?,39?,40?,41?,42?,43+,44+,49-,50+,51-,52+,53-,54+,55+,56-,57+,58+,59-,60+/m1/s1 |
| InChIKey | UWKKMKNUJLSCFX-AVQUHZHVSA-N |
| Literature Reference Author | K.OHTANI,C.MIYAJIMA,T.TAKAHASI,R.KASAI,O.TANAKA,D.R.HAHN,N.N ARUHASHI |
| Literature Reference Citation | PHYTOCHEM.,29,3275(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)80199-Q |
| Molecular Weight | 1035.366 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP6803 |