| SpectraBase Compound ID | H7MOaoNTBCe |
|---|---|
| InChI | InChI=1S/C57H88N10O14/c1-12-34(7)46-55(78)67-28-18-17-22-40(67)51(74)61-45(32(3)4)54(77)64(10)41(25-27-44(70)71)57(80)81-48(35(8)13-2)52(75)60-37(30-36-20-15-14-16-21-36)53(76)66-29-19-23-39(66)49(72)59-31-43(69)65(11)47(33(5)6)56(79)63(9)38(50(73)62-46)24-26-42(58)68/h14-16,20-21,32-35,37-41,45-48H,12-13,17-19,22-31H2,1-11H3,(H2,58,68)(H,59,72)(H,60,75)(H,61,74)(H,62,73)(H,70,71) |
| InChIKey | DJDJISZVDIETFI-UHFFFAOYSA-N |
| Mol Weight | 1137.4 g/mol |
| Molecular Formula | C57H88N10O14 |
| Exact Mass | 1136.648148 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LEoIfVGqi8U |
|---|---|
| Name | SCH_217048 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H88N10O14 |
| InChI | InChI=1S/C57H88N10O14/c1-12-34(7)46-55(78)67-28-18-17-22-40(67)51(74)61-45(32(3)4)54(77)64(10)41(25-27-44(70)71)57(80)81-48(35(8)13-2)52(75)60-37(30-36-20-15-14-16-21-36)53(76)66-29-19-23-39(66)49(72)59-31-43(69)65(11)47(33(5)6)56(79)63(9)38(50(73)62-46)24-26-42(58)68/h14-16,20-21,32-35,37-41,45-48H,12-13,17-19,22-31H2,1-11H3,(H2,58,68)(H,59,72)(H,60,75)(H,61,74)(H,62,73)(H,70,71) |
| InChIKey | DJDJISZVDIETFI-UHFFFAOYSA-N |
| Literature Reference Author | V.R.HEDGE,M.S.PUAR,T.M.CHAN,P.DAI,P.R.DAS,M.PATEL |
| Literature Reference Citation | J.ORG.CHEM.,63,9584(1998) |
| Literature Reference DOI | 10.1021/jo981467j |
| Molecular Weight | 1137.384 g/mol |
| Sample ID | 26649 |
| Solvent | DMSO-D6 |