| SpectraBase Compound ID | D22opddJaWU |
|---|---|
| InChI | InChI=1S/C68H124O24/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-30-49(75)61(85)68-62(86)53(79)38-54(92-68)63(87)59(83)42(4)33-35-51(77)67-66(90)65(89)64(88)55(91-67)37-52(78)56(80)40(2)23-19-31-48(74)60(84)58(82)41(3)32-34-50(76)57(81)43(5)36-46(72)28-21-26-44(70)24-20-25-45(71)27-22-29-47(73)39-69/h6-8,18,22,27,30,40-41,43-90H,1,4,9-17,19-21,23-26,28-29,31-39H2,2-3,5H3/b8-7+,27-22+,30-18+ |
| InChIKey | GYPJDXBMGANEHW-DTUMZGMKSA-N |
| Mol Weight | 1325.7 g/mol |
| Molecular Formula | C68H124O24 |
| Exact Mass | 1324.848255 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 76Kb6eBgrH8 |
|---|---|
| Name | KMTX_3 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H124O24 |
| InChI | InChI=1S/C68H124O24/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-30-49(75)61(85)68-62(86)53(79)38-54(92-68)63(87)59(83)42(4)33-35-51(77)67-66(90)65(89)64(88)55(91-67)37-52(78)56(80)40(2)23-19-31-48(74)60(84)58(82)41(3)32-34-50(76)57(81)43(5)36-46(72)28-21-26-44(70)24-20-25-45(71)27-22-29-47(73)39-69/h6-8,18,22,27,30,40-41,43-90H,1,4,9-17,19-21,23-26,28-29,31-39H2,2-3,5H3/b8-7+,27-22+,30-18+ |
| InChIKey | GYPJDXBMGANEHW-DTUMZGMKSA-N |
| Literature Reference Author | R.M.V.WAGONER,J.R.DEEDS,A.O.TATTERS,A.R.PLACE,C.R.TOMAS,J.L. C.WRIGHT |
| Literature Reference Citation | J.NAT.PROD.,73,1360(2010) |
| Literature Reference DOI | 10.1021/np100158r |
| Molecular Weight | 1325.718 g/mol |
| Sample ID | 36539 |
| Solvent | C5D5N:CD3OD |